ChemicalBook--->CAS DataBase List--->131288-67-0

131288-67-0

131288-67-0 Structure

131288-67-0 Structure
IdentificationBack Directory
[Name]

(S)-2-AMINO-3-CYCLOHEXYL-PROPAN-1-OL
[CAS]

131288-67-0
[Synonyms]

H-CHA-OL
H-PHE(HEXAHYDRO)-OL
L-CYCLOHEXYLALANINOL
()-cyclohexylalaninol
(S)-CYCLOHEXYLALANINOL
(S)-b-Amino-cyclohexanepropanol
(S)-2-amino-3-cyclohexyl-1-propanol
(S)-b-AMino-cyclohexanepropanol HCl
(2S)-2-amino-3-cyclohexyl-1-propanol
Cyclohexanepropanol, β-amino-, (βS)-
(S)-2-AMINO-3-CYCLOHEXYL-PROPAN-1-OL
(2S)-2-amino-3-cyclohexyl-1-propanol(SALTDATA: HCl)
[Molecular Formula]

C9H19NO
[MDL Number]

MFCD00191731
[MOL File]

131288-67-0.mol
[Molecular Weight]

157.25
Chemical PropertiesBack Directory
[Boiling point ]

120 °C(Press: 1 Torr)
[density ]

0.970±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C(protect from light)
[pka]

12.86±0.10(Predicted)
[Appearance]

colorless oil
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H227-H315-H319-H335-H412
[Precautionary statements ]

P261-P305+P351+P338
[Hazard Codes ]

Xn
[Risk Statements ]

22-36
[Safety Statements ]

26
[HS Code ]

2922190090
Spectrum DetailBack Directory
[Spectrum Detail]

(S)-2-AMINO-3-CYCLOHEXYL-PROPAN-1-OL(131288-67-0)1HNMR
Hazard InformationBack Directory
[Synthesis]

BOC-BETA-CYCLOHEXYL-L-ALANINOL

103322-56-1

(S)-2-AMINO-3-CYCLOHEXYL-PROPAN-1-OL

131288-67-0

General Steps: Step 1: Tert-butyl (S)-(1-cyclohexyl-3-hydroxypropan-2-yl)carbamate (4.00 g, 15.5 mmol) was dissolved in a mixed solvent of dichloromethane (10 mL) and a dioxane solution of 4N hydrochloric acid (10 mL), and the reaction was stirred for 16 hours at room temperature. Upon completion of the reaction, the reaction mixture was diluted with dichloromethane (40 mL) and subsequently washed with aqueous ammonium hydroxide solution (30 mL). The aqueous layer was then extracted with dichloromethane (40 mL), all organic layers were combined, dried with magnesium sulfate and concentrated to give (S)-2-amino-3-cyclohexyl-1-propanol (2.78 g, 100% yield). Mass spectral analysis showed m/e 158 (M + H)+.

[References]

[1] Patent: WO2005/14540, 2005, A1. Location in patent: Page/Page column 46
[2] Patent: WO2005/16876, 2005, A2. Location in patent: Page/Page column 35
[3] Chemical and Pharmaceutical Bulletin, 1989, vol. 37, # 9, p. 2570 - 2572
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