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13100-05-5 | 2-Propanone, 1-(2-hydroxyphenyl)-
CAS No: 13100-05-5 Catalog No: AG000VC3 MDL No:MFCD00210437
Product Description
Catalog Number:
AG000VC3
Chemical Name:
2-Propanone, 1-(2-hydroxyphenyl)-
CAS Number:
13100-05-5
Molecular Formula:
C9H10O2
Molecular Weight:
150.1745
MDL Number:
MFCD00210437
IUPAC Name:
1-(2-hydroxyphenyl)propan-2-one
InChI:
InChI=1S/C9H10O2/c1-7(10)6-8-4-2-3-5-9(8)11/h2-5,11H,6H2,1H3
InChI Key:
OCKHLUBUCIHKRG-UHFFFAOYSA-N
SMILES:
CC(=O)Cc1ccccc1O
UNII:
P4H53EI92P
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.068g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
150.177g/mol
Monoisotopic Mass:
150.068g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
Literature
| Title | Journal |
|---|---|
| Sulfur from benzothiophene and alkylbenzothiophenes supports growth of Rhodococcus sp. strain JVH1. | Biodegradation 20071001 |
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