Name: Name:Benzoic acid, 2-methyl-, 2-acetyl-4-methylphenyl ester
Brand: Angene
SKU: AG0089RS
Rating: 90 (10 reviews)

Benzoic acid, 2-methyl-, 2-acetyl-4-methylphenyl ester

CAS No.:

88951-99-9

Catalog Number:

AG0089RS

Molecular Formula:

C17H16O3

Molecular Weight:

268.3071

Catalog Number:

AG0089RS

Chemical Name:

Benzoic acid, 2-methyl-, 2-acetyl-4-methylphenyl ester

CAS Number:

88951-99-9

Molecular Formula:

C17H16O3

Molecular Weight:

268.3071

MDL Number:

MFCD01534322

IUPAC Name:

(2-acetyl-4-methylphenyl) 2-methylbenzoate

InChI:

InChI=1S/C17H16O3/c1-11-8-9-16(15(10-11)13(3)18)20-17(19)14-7-5-4-6-12(14)2/h4-10H,1-3H3

InChI Key:

DUTJMSUCLRYZOV-UHFFFAOYSA-N

SMILES:

Cc1ccc(c(c1)C(=O)C)OC(=O)c1ccccc1C

Complexity:

363

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

268.11g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

268.312g/mol

Monoisotopic Mass:

268.11g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

43.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.7