Name: Name:2-methoxy-2-phenylpropanoic acid
Brand: Angene
SKU: AG01AB6G
Rating: 90 (10 reviews)

2-methoxy-2-phenylpropanoic acid

CAS No.:

7472-67-5

Catalog Number:

AG01AB6G

Molecular Formula:

C10H12O3

Molecular Weight:

180.2005

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Product Description

Catalog Number:

AG01AB6G

Chemical Name:

2-methoxy-2-phenylpropanoic acid

CAS Number:

7472-67-5

Molecular Formula:

C10H12O3

Molecular Weight:

180.2005

MDL Number:

MFCD00231151

IUPAC Name:

2-methoxy-2-phenylpropanoic acid

InChI:

InChI=1S/C10H12O3/c1-10(13-2,9(11)12)8-6-4-3-5-7-8/h3-7H,1-2H3,(H,11,12)

InChI Key:

PGVVKQANLPHXOW-UHFFFAOYSA-N

SMILES:

COC(c1ccccc1)(C(=O)O)C

NSC Number:

402043

Properties

Complexity:

185

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

180.079g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

180.203g/mol

Monoisotopic Mass:

180.079g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6

Literature

Title	Journal
Synthesis of enantiopure 2-aryl-2-methoxypropionic acids and determination of their absolute configurations by X-ray crystallography.	Chirality 20080301