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10268-71-0 | Benzoic acid, 2-methoxy-, phenyl ester
CAS No: 10268-71-0 Catalog No: AG00084C MDL No:
Product Description
Catalog Number:
AG00084C
Chemical Name:
Benzoic acid, 2-methoxy-, phenyl ester
CAS Number:
10268-71-0
Molecular Formula:
C14H12O3
Molecular Weight:
228.2433
IUPAC Name:
phenyl 2-methoxybenzoate
InChI:
InChI=1S/C14H12O3/c1-16-13-10-6-5-9-12(13)14(15)17-11-7-3-2-4-8-11/h2-10H,1H3
InChI Key:
LZRFQYZCMVMADF-UHFFFAOYSA-N
SMILES:
COc1ccccc1C(=O)Oc1ccccc1
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.079g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.247g/mol
Monoisotopic Mass:
228.079g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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