ChemicalBook >> CAS DataBase List >>BOC-L-Isoleucine

BOC-L-Isoleucine

CAS No.
13139-16-7
Chemical Name:
BOC-L-Isoleucine
Synonyms
BOC-ILE-OH;Boc-L-lle-OH;N-Boc-L-isoleucine;BOC-L-Ile;BOC-ISOLEUCINE;Boc-L-Isovaline;N-(tert-Butyloxycarbonyl)-L-isoleucine;Boc-lIe-OH;Boc-IIe-OH;Boc-Ile-OH1
CBNumber:
CB4690221
Molecular Formula:
C11H21NO4
Molecular Weight:
231.29
MDL Number:
MFCD00038324
MOL File:
13139-16-7.mol
MSDS File:
SDS
Last updated:2026-01-13 11:20:14
Product description Number Pack Size Price
Boc-Ile-OH 98% 359653 25g $128
N-(tert-Butoxycarbonyl)-L-isoleucine Hemihydrate >99.0%(T) B1186 5g $32
N-(tert-Butoxycarbonyl)-L-isoleucine Hemihydrate >99.0%(T) B1186 25g $79
N-Boc-L-isoleucine B657225 100g $200
N-Boc-L-isoleucine 458374 10g $312
More product size

BOC-L-Isoleucine Properties

Melting point 66-69 °C(lit.)
alpha 2 º (c=2,CH3COOH)
Boiling point 373.37°C (rough estimate)
Density 1.1202 (rough estimate)
refractive index 2.7 ° (C=2, AcOH)
storage temp. Keep in dark place,Sealed in dry,Room Temperature
solubility Acetic Acid, DMSO (Slightly), Methanol (Slightly)
form Solid
pka 4.03±0.22(Predicted)
color White to Off-White
optical activity [α]20/D +2.7°, c = 2 in acetic acid
Water Solubility Soluble in methanol. Insoluble in water.
BRN 1711700
Major Application peptide synthesis
InChI 1S/C11H21NO4/c1-6-7(2)8(9(13)14)12-10(15)16-11(3,4)5/h7-8H,6H2,1-5H3,(H,12,15)(H,13,14)/t7-,8-/m0/s1
InChIKey QJCNLJWUIOIMMF-YUMQZZPRSA-N
SMILES CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(O)=O
CAS DataBase Reference 13139-16-7(CAS DataBase Reference)
EPA Substance Registry System L-Isoleucine, N-[(1,1-dimethylethoxy)carbonyl]- (13139-16-7)
UNSPSC Code 12352209
NACRES NA.22

SAFETY

Risk and Safety Statements

Symbol(GHS)  GHS hazard pictograms
GHS07
Signal word  Warning
Hazard statements  H335-H315-H319
Precautionary statements  P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
PPE Eyeshields, Gloves, type N95 (US)
Hazard Codes  Xn
Risk Statements  20/21/22-36/37/38
Safety Statements  24/25-36-26
WGK Germany  3
TSCA  TSCA listed
HS Code  29241990
Storage Class 11 - Combustible Solids
NFPA 704
1
0 0

BOC-L-Isoleucine price More Price(33)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich 359653 Boc-Ile-OH 98% 13139-16-7 25g $128 2025-07-31 Buy
TCI Chemical B1186 N-(tert-Butoxycarbonyl)-L-isoleucine Hemihydrate >99.0%(T) 13139-16-7 5g $32 2025-07-31 Buy
TCI Chemical B1186 N-(tert-Butoxycarbonyl)-L-isoleucine Hemihydrate >99.0%(T) 13139-16-7 25g $79 2025-07-31 Buy
TRC B657225 N-Boc-L-isoleucine 13139-16-7 100g $200 2021-12-16 Buy
Usbiological 458374 N-Boc-L-isoleucine 13139-16-7 10g $312 2021-12-16 Buy
Product number Packaging Price Buy
359653 25g $128 Buy
B1186 5g $32 Buy
B1186 25g $79 Buy
B657225 100g $200 Buy
458374 10g $312 Buy

BOC-L-Isoleucine Chemical Properties,Uses,Production

Chemical Properties

white fine crystalline powder

Uses

N-Boc-L-isoleucine is used to prepare BOC-L-isoleucine hydroxysuccinimide ester by using 1-hydroxybenzotriazole and 1-ethyl-3-<3-(dimethylamino)propyl>carbodiimide hydrochloride.

reaction suitability

reaction type: Boc solid-phase peptide synthesis
reaction type: C-H Activation
reagent type: ligand
reaction type: Peptide Synthesis

Synthesis

L-Isoleucine

73-32-5

Di-tert-butyl dicarbonate

24424-99-5

BOC-L-Isoleucine

13139-16-7

GENERAL STEPS: L-isoleucine (1.31 g, 10 mmol, 1.0 equiv) was dissolved in 20.5 mL of 1 M NaOH solution and cooled in an ice bath. Di-tert-butyl dicarbonate (Boc2O, 2.62 g, 12 mmol, 1.2 equiv) dissolved in 7 mL of dioxane was added slowly. The reaction mixture was stirred at ambient temperature for 24 hours. Subsequently, the pH of the reaction solution was adjusted to 10 with 1 M NaOH and ether was added for phase separation. The aqueous phase was acidified to pH 2 with 1 M HCl and extracted with ethyl acetate (EtOAc). The combined organic phases were washed with saturated brine and dried over anhydrous sodium sulfate. The solvent was removed under reduced pressure to give BOC-L-isoleucine as a colorless oil (2.20 g, 95% yield). IR (cm-1): 3292 (w), 2967 (m), 2934 (w), 2880 (w), 1713 (s), 1661 (m), 1504 (m), 1465 (w), 1394 (m), 1368 (s), 1242 (m), 1159 (s), 1121 (m), 1046 (m), 1019 (w), 857 (w), 778 857 (w), 778 (w), 657 (w). 1H NMR (500 MHz, CDCl3) δ: 0.94 (t, J = 7.3 Hz, 3H, H-6), 0.98 (d, J = 7 Hz, 3H, H-4), 1.15-1.29 (m, 1H, H-5a), 1.46 (s, 9H, H-9/10/11), 1.46-1.54 (m, partially overlapped, 1H, H-5b), 1.83-1.99 (m, 1H, H-3), 4.30 (dd, J = 8.9, 4.6 Hz, 1H, H-2), 5.02 (d, J = 8.9 Hz, 1H, NH). 13C NMR (125 MHz, CDCl3) δ: 11.8 (C-6), 15.7 (C-4), 25.0 (C-5), 28.5 (C-9/10/11), 37.9 (C-3), 58.0 (C-2), 80.2 (C-8), 155.9 (C-7), 177.2 (C-1). HRMS (ESI) m/z: [M-H]- calcd for C11H20NO4 230.13868, found 230.13926. [α]20D +3.6 (c 2.00, CH3OH) (Lit [3]: [α]25D +3.8 (c 1.01, CH3OH)).

References

[1] Tetrahedron Letters, 2005, vol. 46, # 38, p. 6537 - 6540
[2] Bioorganic and Medicinal Chemistry, 2010, vol. 18, # 17, p. 6340 - 6350
[3] Bioorganic and Medicinal Chemistry, 2014, vol. 22, # 14, p. 3573 - 3586
[4] Tetrahedron, 1992, vol. 48, # 37, p. 8007 - 8022
[5] Tetrahedron, 2006, vol. 62, # 31, p. 7274 - 7283

24424-99-5
13139-16-7
Synthesis of BOC-L-Isoleucine from Di-tert-butyl dicarbonate
Global( 388)Suppliers
Supplier Tel Email Country ProdList Advantage
Sichuan HongRi Pharma-Tech Co.,Ltd
+8617390183901 cynthia@enlaibio.com China 1098 58
Capot Chemical Co.,Ltd.
+86-(0)57185586718; +8613336195806 sales@capot.com China 29735 60
ATK CHEMICAL COMPANY LIMITED
+undefined-21-51877795 ivan@atkchemical.com China 33024 60
AB PharmaTech,LLC
323-480-4688 sales@acrospharmatech.com United States 989 55
career henan chemical co
+86-0371-86658258 +8613203830695 sales@coreychem.com China 29831 58
Xiamen AmoyChem Co., Ltd
+86-86-5926051114 +8615060885618 sales@amoychem.com China 6369 58
Hubei xin bonus chemical co. LTD
86-13657291602 linda@hubeijusheng.com CHINA 22963 58
Shandong chuangyingchemical Co., Ltd.
18853181302 sale@chuangyingchem.com CHINA 5906 58
Alchem Pharmtech,Inc.
8485655694 sales@alchempharmtech.com United States 63687 58
CONIER CHEM AND PHARMA LIMITED
+8618523575427 sales@conier.com China 49977 58

View Lastest Price from BOC-L-Isoleucine manufacturers

Image Update time Product Price Min. Order Purity Supply Ability Manufacturer
BOC-L-Isoleucine pictures 2026-02-13 BOC-L-Isoleucine
13139-16-7
US $0.00-0.00 / kg 1kg 98%min 1000kg WUHAN FORTUNA CHEMICAL CO., LTD
Boc-Ile-OH pictures 2026-02-02 Boc-Ile-OH
13139-16-7
US $0.00-0.00 / kg 1kg 98% 1T Sichuan HongRi Pharma-Tech Co.,Ltd
Boc-Ile-OH pictures 2026-01-04 Boc-Ile-OH
13139-16-7
US $34.00 / mg 10g TargetMol Chemicals Inc.
  • BOC-L-Isoleucine pictures
  • BOC-L-Isoleucine
    13139-16-7
  • US $0.00-0.00 / kg
  • 98%min
  • WUHAN FORTUNA CHEMICAL CO., LTD
  • Boc-Ile-OH pictures
  • Boc-Ile-OH
    13139-16-7
  • US $0.00-0.00 / kg
  • 98%
  • Sichuan HongRi Pharma-Tech Co.,Ltd
  • Boc-Ile-OH pictures
  • Boc-Ile-OH
    13139-16-7
  • US $34.00 / mg
  • TargetMol Chemicals Inc.
BOC-L-ISOLEUCINE BOC-L-ISOLEUCINE-OH N-(TERT-BUTOXYCARBONYL)-L-ISOLEUCINE N-T-BOC-L-ISOLEUCINE N-ALPHA-T-BOC-L-ISOLEUCINE N-ALPHA-T-BUTOXYCARBONYL-L-ISOLEUCINE L-Isoleucine, N-[(1,1-dimethylethoxy)carbonyl]- (2S)-N-(tert-Butoxycarbonyl)-L-isoleucine (2S,3S)-2-[(tert-Butyloxycarbonyl)amino]-3-methylpentanoic acid N-(tert-Butoxycarbonyl)isoleucine BOC-L-ISOLEUCINE extrapure N-(tert-Butoxycarbonyl)-L-isoleucine, Boc-L-isoleucine N-(tert-Butoxycarbonyl)-L-isoleucine ,99% (S)-N-BOC-ISOLEUCINE L-ISOLEUCINE-N-T-BOC Boc-lle-OH·1/2 H2O Boc-L-isoleucine heMihydrate N-Boc-L-isoleucine Boc-Ile-OH (2S,3S)-2-((tert-Butoxycarbonyl)aMino)-3-Methylpentanoic acid (2S,3S)-2-((tert-Butoxycarbonyl)aMino)-3-Methylpentanoic acid/BOC-L-ILe-OH Boc-L-Isoleucine, 95+% Boc-Ile-OH1 Boc-Ile-OH 98% Boc-(2S,3S)-2-amino-3-methylpentanoic acid Boc-L-isoleucine≥ 99% (Assay) N-T-BOC-L-ISOLEUCINE CRYSTALLINE N-(TERT-BUTOXYCARBONYL)-L-ISOLEUCINE, 98 % Boc-Ile-OH.5H2O n-[(1,1-dimethylethoxy)carbonyl]-l-isoleucin BOC-L-Isoleucine, 99+% Boc-lle-OH.1/2H2O boc-ile-oh,0.5h20 N-ALPHA-T-BUTYLOXYCARBONYL-L-ISOLEUCINE SEMIHYDRATE Boc-L-isoleucine· 1/2H2O Boc-Isoleucine, 0.5 H2O Boc-Ile-OH.H2O N-tert-Butoxycarbonyl-L-isoleucine·1/2H2O N-tert-Butoxycarbonyl-L-isoleucine monohydrate N-Boc-L-isoleucine, 98+% Boc-Ile-OH·½H2O Isoleucine, N-carboxy-, N-tert-butyl ester, L- 3-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanoic acid hydrate Boc-L-isoleucine, Anhydrous N-(tert-Butoxycarbonyl)-L-isoleucine Hemihydrate> BOC-L-Isoleucine USP/EP/BP N-(TERT-BUTOXYCARBONYL)-L-ISOLEUNICE HEM IHYDRATE BOC-ISOLEUCINE BOC-ILE-OH N-(tert-Butyloxycarbonyl)-L-isoleucine BOC-L-Ile Boc-L-Isovaline N-Boc-L-isoleucine Boc-L-lle-OH Boc-L-Isoleucin Boc-lIe-OH (Tert-butoxycarbonyl)-L-isoleucine BOC-L-Isoleucine-OH 98% Boc-Ile-OH/98%/13139-16-7 Boc-IIe-OH