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Sigma-Aldrich

(R)-(+)-1-Phenyl-1-butanol

97%

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About This Item

Linear Formula:
CH3CH2CH2CH(C6H5)OH
CAS Number:
22144-60-1
Molecular Weight:
150.22
MDL number:
MFCD00004575
UNSPSC Code:
12352002
PubChem Substance ID:
24859072
NACRES:
NA.22

assay

97%

form

solid

optical activity

[α]20/D +55°, c = 5 in chloroform

optical purity

ee: 98% (GLC)

bp

115 °C/14 mmHg (lit.)

mp

44-46 °C (lit.)

SMILES string

CCC[C@@H](O)c1ccccc1

InChI

1S/C10H14O/c1-2-6-10(11)9-7-4-3-5-8-9/h3-5,7-8,10-11H,2,6H2,1H3/t10-/m1/s1

InChI key

HQRWWHIETAKIMO-SNVBAGLBSA-N

Application

(R)-(+)-1-Phenyl-1-butanol can be used as a substrate in the thermodynamic studies of:
  • Transesterification of phenyl alkanols with butyl acetate in the presence of lipase enzyme.
  • Reduction of phenyl alkanones in the presence of ketoreductase enzyme.

Storage Class

11 - Combustible Solids

wgk_germany

WGK 3

flash_point_f

217.4 °F - closed cup

flash_point_c

103.00 °C - closed cup

ppe

Eyeshields, Gloves, type N95 (US)

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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A thermodynamic study of ketoreductase-catalyzed reactions 3. Reduction of 1-phenyl-1-alkanones in non-aqueous solvents
Tewari YB, et al.
The Journal of Chemical Thermodynamics, 38(10), 1165-1171 (2006)
Thermodynamics of the lipase-catalyzed transesterification of 1-phenyl-1-alkanols and butyl acetate in organic solvents
Tewari YB, et al.
Journal of Molecular Catalysis. B, Enzymatic, 21(3), 123-131 (2003)

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