General
Preferred name
(S)-(-)-Phenylethanol
Synonyms
(S)-1-Phenylethanol, (S)-(-)-Phenylethanol ()
(S)-(-)-1-Phenylethanol ()
P&D ID
PD054520
CAS
1445-91-6
Tags
available
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
PRICE 29
DESCRIPTION (S)-(-)-Phenylethanol ((-)-Methyl phenyl carbinol) exists as a solid, soluble (in water), and a very weakly acidic compound (based on its pKa). (S)-(-)-Phenylethanol has been detected in multiple biofluids, such as feces and saliva. Within the cell, (S)-(-)-Phenylethanol is primarily located in the cytoplasm.
Compound Sets
1
Selleckchem Bioactive Compound Library
External IDs
32
Properties
(calculated by RDKit )
Molecular Weight
122.07
Hydrogen Bond Acceptors
1
Hydrogen Bond Donors
1
Rotatable Bonds
1
Ring Count
1
Aromatic Ring Count
1
cLogP
1.74
TPSA
20.23
Fraction CSP3
0.25
Chiral centers
1.0
Largest ring
6.0
QED
0.6
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Source data