Benzoicacid, 2-amino-4,5-dimethyl- supplier

Name
4,5-Dimethylanthanilic acid
EINECS 809-202-0
CAS No. 15089-51-7
Article Data4
CAS DataBase
Density 1.208 g/cm³
Solubility
Melting Point 213-214 °C (decomp)
Formula C₉H₁₁NO₂
Boiling Point 341.656 °C at 760 mmHg
Molecular Weight 165.192
Flash Point 160.428 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Anthranilic acid, 4,5-dimethyl- (8CI);2-Carboxy-4,5-dimethylaniline;4,5-Dimethyl-2-aminobenzoic acid;4,5-Dimethylanthranilic acid;
PSA 63.32000
LogP 2.16500

Benzoicacid, 2-amino-4,5-dimethyl- Specification

The Benzoicacid, 2-amino-4,5-dimethyl-, with the CAS registry number 15089-51-7, is also known as 4,5-Dimethylanthanilic acid. This chemical's molecular formula is C₉H₁₁NO₂ and molecular weight is 165.19. What's more, both its IUPAC name and systematic name are the same which is called 2-Amino-4,5-dimethylbenzoic acid.

Physical properties about Benzoicacid, 2-amino-4,5-dimethyl- are: (1)ACD/LogP: 2.04; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.26; (4)ACD/LogD (pH 7.4): -0.44; (5)ACD/BCF (pH 5.5): 3.47; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 50.86; (8)ACD/KOC (pH 7.4): 1.03; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 63.32 Å²; (13)Index of Refraction: 1.604; (14)Molar Refractivity: 47.069 cm³; (15)Molar Volume: 136.793 cm³; (16)Polarizability: 18.66×10^-24cm³; (17)Surface Tension: 53.827 dyne/cm; (18)Density: 1.208 g/cm³; (19)Flash Point: 160.428 °C; (20)Enthalpy of Vaporization: 61.777 kJ/mol; (21)Boiling Point: 341.656 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(O)c1cc(c(cc1N)C)C
(2) InChI: InChI=1S/C9H11NO2/c1-5-3-7(9(11)12)8(10)4-6(5)2/h3-4H,10H2,1-2H3,(H,11,12)
(3) InChIKey: REBBDMHTSKPGCO-UHFFFAOYSA-N

Product Name

4,5-Dimethylanthanilic acid

Benzoicacid, 2-amino-4,5-dimethyl- Specification

Related Products

Hot Products