4-Acetamido-2-methylbenzoic acid methyl ester

CAS

91133-71-0

Catalog Number

ACM91133710

Category

Other Products

Molecular Weight

207.225820 [g/mol]

Molecular Formula

C₁₁H₁₃NO₃

MSDS COA Spec Sheet

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Specification

Synonyms

91133-71-0, METHYL 4-ACETYLAMINO-2-METHYLBENZATE, SureCN5327455, Methyl 4-acetamido-2-methylbenzoate, methyl 4-acetamido-2-methyl-benzoate, AK140741, 4-acetamido-2-methylbenzoic acid methyl ester, 4-Acetylamino-2-methyl-benzoic acid methyl ester, A843734

IUPAC Name

methyl 4-acetamido-2-methylbenzoate

InChI Key

SXVFWPMLEPDWEP-UHFFFAOYSA-N

Exact Mass

207.09000

H-Bond Acceptor

H-Bond Donor

What is the molecular formula of the compound?

The molecular formula is C11H13NO3.

What are the synonyms of the compound?

The synonyms of the compound are Methyl 4-acetamido-2-methylbenzoate, 91133-71-0, METHYL 4-ACETYLAMINO-2-METHYLBENZATE, Methyl4-acetamido-2-methylbenzoate, and 4-acetamido-2-methylbenzoic acid methyl ester.

What is the molecular weight of the compound?

The molecular weight of the compound is 207.23 g/mol.

What is the IUPAC name of the compound?

The IUPAC name of the compound is methyl 4-acetamido-2-methylbenzoate.

What is the InChI of the compound?

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

What is the InChIKey of the compound?

The InChIKey of the compound is SXVFWPMLEPDWEP-UHFFFAOYSA-N.

What is the canonical SMILES of the compound?

The canonical SMILES of the compound is CC1=C(C=CC(=C1)NC(=O)C)C(=O)OC.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value of the compound is 1.3.