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1-Phenyl-2-Butanol
[CAS# 701-70-2]

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Identification
Classification Chemical reagent >> Organic reagent >> Aromatic alcohol
Name 1-Phenyl-2-Butanol
Synonyms St5410839; Nsc406921; Alpha-Ethylphenethyl Alcohol
Molecular Structure CAS#: 701-70-2, 1-Phenyl-2-Butanol
Molecular Formula C10H14O
Molecular Weight 150.22
CAS Registry Number 701-70-2 (120055-09-6)
EINECS 211-858-2
SMILES C1=C(CC(CC)O)C=CC=C1
InChI 1S/C10H14O/c1-2-10(11)8-9-6-4-3-5-7-9/h3-7,10-11H,2,8H2,1H3
InChIKey LYUPJHVGLFETDG-UHFFFAOYSA-N
Properties
Density 0.981g/cm3 (Cal.)
Boiling point 226.606°C at 760 mmHg (Cal.)
Flash point 100°C (Cal.)
Safety Data
SDS Available
References
(1) Christopher J. C. WhitehouseThese authors contributed equally to the work, Wen Yang, Jake A. Yorke, Henry G. Tufton, Lydia C. I. Ogilvie, Stephen G. Bell, Weihong Zhou, Mark Bartlam, Zihe Rao and Luet-Lok Wong. Structure, electronic properties and catalytic behaviour of an activity-enhancing CYP102A1 (P450BM3) variant, Dalton Trans., 2011, 40, 10383.
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