Home Other Building Blocks 4-[(1S)-1-hydroxyethyl]phenol

4-[(1S)-1-hydroxyethyl]phenol

CAS No.:
93781-59-0
Catalog Number:
AG01AUQT
Molecular Formula:
C8H10O2
Molecular Weight:
138.1638
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Product Description
Catalog Number:
AG01AUQT
Chemical Name:
4-[(1S)-1-hydroxyethyl]phenol
CAS Number:
93781-59-0
Molecular Formula:
C8H10O2
Molecular Weight:
138.1638
MDL Number:
MFCD18339785
IUPAC Name:
4-[(1S)-1-hydroxyethyl]phenol
InChI:
InChI=1S/C8H10O2/c1-6(9)7-2-4-8(10)5-3-7/h2-6,9-10H,1H3/t6-/m0/s1
InChI Key:
PMRFBLQVGJNGLU-LURJTMIESA-N
SMILES:
Oc1ccc(cc1)[C@@H](O)C
Properties
Complexity:
95.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
138.068g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
138.166g/mol
Monoisotopic Mass:
138.068g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Literature
Title Journal
Seasonal variation in leaf glucosinolates and insect resistance in two types of Barbarea vulgaris ssp. arcuata. Phytochemistry 20010901
Properties