Name: Name:2,3-Dimethylbenzoic acid
Brand: AABLOCKS
SKU: AA00IALS
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA00IALS

Chemical Name: 2,3-Dimethylbenzoic acid

CAS Number: 603-79-2

Molecular Formula: C9H10O2

Molecular Weight: 150.1745

MDL Number: MFCD00002479

SMILES: CC1=CC=CC(=C1C)C(=O)O

NSC Number: 407533

Properties

BP: 281.5°C at 760 mmHg

Form: Solid

MP: 144-146 °C(lit.)

Refractive Index: 1.5188 (estimate)

Storage: Keep in dry area;Room Temperature;

Complexity: 154

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 11

Hydrogen Bond Acceptor Count: 2

Hydrogen Bond Donor Count: 1

Isotope Atom Count: 0

Rotatable Bond Count: 1

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 2.8

Literature fold

Title: Structural relaxation dynamics in binary glass-forming molecular liquids with ideal and complex mixing behavior.

Journal: The journal of physical chemistry. B20100318

Title: [The effect of selective cyclooxygenase-2 inhibitor nimesulide on breast cancer induced by dimethylbenzoic acid in rats].

Journal: Zhonghua wai ke za zhi [Chinese journal of surgery]20050801

603-79-2 | 2,3-Dimethylbenzoic acid