CAS 1860-58-8 | 2-(3-(Benzyloxy)phenyl)acetic acid | CAS Number 1860-58-8

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1860-58-8 | 2-(3-(Benzyloxy)phenyl)acetic acid

CAS No: 1860-58-8 Catalog No: AG003BQY MDL No:MFCD02664806

Product Description

Catalog Number:

AG003BQY

Chemical Name:

2-(3-(Benzyloxy)phenyl)acetic acid

CAS Number:

1860-58-8

Molecular Formula:

C15H14O3

Molecular Weight:

242.2699

MDL Number:

MFCD02664806

IUPAC Name:

2-(3-phenylmethoxyphenyl)acetic acid

InChI:

InChI=1S/C15H14O3/c16-15(17)10-13-7-4-8-14(9-13)18-11-12-5-2-1-3-6-12/h1-9H,10-11H2,(H,16,17)

InChI Key:

LLZKAZNUCYYBQO-UHFFFAOYSA-N

SMILES:

OC(=O)Cc1cccc(c1)OCc1ccccc1

Properties

Complexity:

259

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

242.094g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

242.274g/mol

Monoisotopic Mass:

242.094g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

Literature

Title	Journal
Biocatalytic organic synthesis of optically pure (S)-scoulerine and berbine and benzylisoquinoline alkaloids.	The Journal of organic chemistry 20110819
Ethers of 3-hydroxyphenylacetic acid as selective gamma-hydroxybutyric acid receptor ligands.	Bioorganic & medicinal chemistry letters 20050701