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295320-25-1 | Benzeneacetic acid, 3-hydroxy-, phenylmethyl ester
CAS No: 295320-25-1 Catalog No: AG002YNR MDL No:
Product Description
Catalog Number:
AG002YNR
Chemical Name:
Benzeneacetic acid, 3-hydroxy-, phenylmethyl ester
CAS Number:
295320-25-1
Molecular Formula:
C15H14O3
Molecular Weight:
242.2699
IUPAC Name:
benzyl 2-(3-hydroxyphenyl)acetate
InChI:
InChI=1S/C15H14O3/c16-14-8-4-7-13(9-14)10-15(17)18-11-12-5-2-1-3-6-12/h1-9,16H,10-11H2
InChI Key:
ALFOBMRIXXPJLQ-UHFFFAOYSA-N
SMILES:
O=C(Cc1cccc(c1)O)OCc1ccccc1
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.094g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
242.274g/mol
Monoisotopic Mass:
242.094g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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