| Identification | More | [Name]
6-Amino-1-hexanol | [CAS]
4048-33-3 | [Synonyms]
6-AMINO-1-HEXANOL
6-AMINOHEXANOL
6-AMINO-N-CAPROYL ALCOHOL
H-ACP(6)-OL
H-ACP-OL
H-AHX-OL
NH2-(CH2)6-OH
RARECHEM AN KA 1117
TIMTEC-BB SBB006584
1-Amino-6-hexanol
1-Hexanol, 6-amino-
6-amino-hexano
6-Hydroxyhexylamine
Amidohexylalkohol
Aminohexyl alcohol
aminohexylalcohol
H2NCH2(CH2)4CH2OH
Hexanol, 6-amino-
6-Aminohexan-1-ol
6-Hydroxy-1-hexylamine | [EINECS(EC#)]
223-748-1 | [Molecular Formula]
C6H15NO | [MDL Number]
MFCD00008241 | [Molecular Weight]
117.19 | [MOL File]
4048-33-3.mol |
| Chemical Properties | Back Directory | [Appearance]
slightly yellow crystalline powder | [Melting point ]
54-58 °C (lit.) | [Boiling point ]
135-140 °C/30 mmHg (lit.) | [density ]
0.8872 (estimate) | [refractive index ]
1.4444 (estimate) | [Fp ]
133 °C
| [storage temp. ]
Store at?0-5°C | [solubility ]
DMSO (Slightly), Chloroform (Slightly), Methanol (Slightly) | [form ]
Crystals | [pka]
15.18±0.10(Predicted) | [color ]
Light yellow to brown | [Stability:]
Hygroscopic. Stable. Incompatible with strong oxidizing agents. | [Water Solubility ]
MISCIBLE | [Sensitive ]
Hygroscopic | [BRN ]
1732524 | [InChI]
1S/C6H15NO/c7-5-3-1-2-4-6-8/h8H,1-7H2 | [InChIKey]
SUTWPJHCRAITLU-UHFFFAOYSA-N | [SMILES]
NCCCCCCO | [CAS DataBase Reference]
4048-33-3(CAS DataBase Reference) | [NIST Chemistry Reference]
NH2(CH2)6OH(4048-33-3) | [EPA Substance Registry System]
4048-33-3(EPA Substance) |
| Safety Data | Back Directory | [Symbol(GHS) ]
GHS05 | [Signal word ]
Danger | [Hazard statements ]
H314 | [Precautionary statements ]
P260-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363 | [Hazard Codes ]
Xi | [Risk Statements ]
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S37/39:Wear suitable gloves and eye/face protection .
S36:Wear suitable protective clothing . | [WGK Germany ]
3
| [RTECS ]
MO8840000
| [F ]
3-10 | [HazardClass ]
IRRITANT, HYGROSCOPIC | [HS Code ]
29221990 | [Storage Class]
8A - Combustible corrosive hazardous materials | [Hazard Classifications]
Eye Dam. 1
Skin Corr. 1B |
| Hazard Information | Back Directory | [Chemical Properties]
slightly yellow crystalline powder | [Uses]
6-Amino-1-hexanol is used in the synthesis of guanidino analogs of roscovitine, which is a cyclin-dependant kinase. Also used in the preparation of tocotrienols which maintain anticancer, antiprolifer
ative and antimigratory activity. Behery, F | [Synthesis]
By volume ratio, 1 part of 6-aminohexanoic acid was added to the reactor containing 15 parts of diethyl ether or dry toluene solution At 40 ℃ constant temperature, At 1500rpm / min speed, rapidly injected 2 parts of a solution of sodium borohydride. At 250W, ultrasonic treatment 20min. Then, dropwise under reflux, 8 parts of ethylene glycol solution. Dropwise addition time was 30 minutes. Finally, at 90 ℃ and at a rate of 800rpm/min, maintain temperature under stirring and react for 16 h to obtain the reaction crude product. (2) By the amount of parts count, step (1) preparation of 1 part of the reaction crude was added 6 parts water for hydrolysis. Undrego vacuum distillation, collecting 125 ℃ fraction, to obtain the 6-amino-1-hexanol product.
| [References]
[1] Chemical Communications, 2014, vol. 50, # 76, p. 11211 - 11213
[2] Canadian Journal of Chemistry, 1958, vol. 36, p. 147,149
[3] Angewandte Chemie - International Edition, 2011, vol. 50, # 44, p. 10377 - 10380
[4] Tetrahedron Letters, 2013, vol. 54, # 21, p. 2674 - 2678
[5] Patent: US9463451, 2016, B2. Location in patent: Page/Page column 46-50 |
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