Name: Name:Benzoic acid, 4-(acetylamino)-3-methyl-, methyl ester (9CI)
Brand: Angene
SKU: AG00BJSV
Rating: 90 (10 reviews)

Benzoic acid, 4-(acetylamino)-3-methyl-, methyl ester (9CI)

CAS No.:

239075-25-3

Catalog Number:

AG00BJSV

Molecular Formula:

C11H13NO3

Molecular Weight:

207.2258

Catalog Number:

AG00BJSV

Chemical Name:

Benzoic acid, 4-(acetylamino)-3-methyl-, methyl ester (9CI)

CAS Number:

239075-25-3

Molecular Formula:

C11H13NO3

Molecular Weight:

207.2258

MDL Number:

MFCD20540653

IUPAC Name:

methyl 4-acetamido-3-methylbenzoate

InChI:

InChI=1S/C11H13NO3/c1-7-6-9(11(14)15-3)4-5-10(7)12-8(2)13/h4-6H,1-3H3,(H,12,13)

InChI Key:

KGSWFKCUXPXLSK-UHFFFAOYSA-N

SMILES:

COC(=O)c1ccc(c(c1)C)NC(=O)C

Complexity:

252

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

207.09g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

207.229g/mol

Monoisotopic Mass:

207.09g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2