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131980-30-8

131980-30-8 Structure

131980-30-8 Structure
IdentificationMore
[Name]

BOC-L-3-CYANOPHENYLALANINE
[CAS]

131980-30-8
[Synonyms]

BOC-3-CYANO-L-PHENYLALANINE
BOC-L-3-CYANOPHE
BOC-L-3-CYANOPHENYLALANINE
BOC-M-CYANO-L-PHE-OH
BOC-PHE(3-CN)-OH
BOC-PHE(M-CN)-OH
N-ALPHA-T-BUTOXYCARBONYL-L-3-CYANO-L-PHENYLALANINE
N-ALPHA-T-BUTOXYCARBONYL-L-M-CYANO-L-PHENYLALANINE
N-TBOC-M-CYANO-L-PHENYLALANINE
N-TERT-BUTOXYCARBONYL-3-CYANOPHENYL-L-ALANINE
RARECHEM BK PT 0152
(S)-2-(TERT-BUTOXYCARBONYLAMINO)-3-(3-CYANOPHENYL)PROPANOIC ACID
(S)-N-BOC-3-CYANOPHENYLALANINE
Boc-L-3-CN-Phe-OH
(S)-N-BOC-3-CYANOPHENYLALANINE 98%
BOC-L-3-CYANO-PHE-OH
(S)-N-BOC-3-CYANOPHENYLALANINE, 95%, 98% EE
(S)-N-BOC-3-Cyanophenylalanine, 98% ee
[Molecular Formula]

C15H18N2O4
[MDL Number]

MFCD00797560
[Molecular Weight]

290.31
[MOL File]

131980-30-8.mol
Chemical PropertiesBack Directory
[Appearance]

off-white to light yellow crystalline powder
[Melting point ]

124.1 °C
[Boiling point ]

432.4°C (rough estimate)
[density ]

1.1611 (rough estimate)
[refractive index ]

1.6280 (estimate)
[storage temp. ]

Store at 0°C
[form ]

Solid
[pka]

3.75±0.10(Predicted)
[Optical Rotation]

26.2786° (C=0.7997 g/100ml, ETOH)
[Major Application]

peptide synthesis
[InChI]

1S/C15H18N2O4/c1-15(2,3)21-14(20)17-12(13(18)19)8-10-5-4-6-11(7-10)9-16/h4-7,12H,8H2,1-3H3,(H,17,20)(H,18,19)/t12-/m0/s1
[InChIKey]

FDQDHMZKOPOWFE-LBPRGKRZSA-N
[SMILES]

CC(C)(C)OC(=O)N[C@@H](Cc1cccc(c1)C#N)C(O)=O
[CAS DataBase Reference]

131980-30-8(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H312-H332
[Precautionary statements ]

P261-P280h-P301+P312a-P304+P340-P321-P501a
[Hazard Codes ]

Xn
[Risk Statements ]

R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S36/37:Wear suitable protective clothing and gloves .
[WGK Germany ]

3
[HazardClass ]

6.1
[HazardClass ]

IRRITANT
[HS Code ]

29223900
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Chemical Properties]

off-white to light yellow crystalline powder
[Uses]

peptide synthesis
[reaction suitability]

reaction type: Boc solid-phase peptide synthesis
Spectrum DetailBack Directory
[Spectrum Detail]

BOC-L-3-CYANOPHENYLALANINE(131980-30-8)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

(S)-N-BOC-3-Cyanophenylalanine, 98% ee, 95%(131980-30-8)
[Sigma Aldrich]

131980-30-8(sigmaaldrich)
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