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28988-68-3 | Benzeneacetic acid, 3-hydroxy-4-(phenylmethoxy)-
CAS No: 28988-68-3 Catalog No: AG002V43 MDL No:MFCD16293773
Product Description
Catalog Number:
AG002V43
Chemical Name:
Benzeneacetic acid, 3-hydroxy-4-(phenylmethoxy)-
CAS Number:
28988-68-3
Molecular Formula:
C15H14O4
Molecular Weight:
258.2693
MDL Number:
MFCD16293773
IUPAC Name:
2-(3-hydroxy-4-phenylmethoxyphenyl)acetic acid
InChI:
InChI=1S/C15H14O4/c16-13-8-12(9-15(17)18)6-7-14(13)19-10-11-4-2-1-3-5-11/h1-8,16H,9-10H2,(H,17,18)
InChI Key:
CLBBKCKVVIGYBT-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1ccc(c(c1)O)OCc1ccccc1
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.089g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
258.273g/mol
Monoisotopic Mass:
258.089g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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