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5-Pyrimidinecarboxylicacid, 2,4-dimethyl- (74356-36-8)

Identification
Name:5-Pyrimidinecarboxylicacid, 2,4-dimethyl-
Synonyms:2,4-Dimethylpyrimidine-5-carboxylicacid;
CAS:74356-36-8
Molecular Formula: C7H8N2O2
Molecular Weight: 152.15
InChI: InChI=1/C7H8N2O2/c1-4-6(7(10)11)3-8-5(2)9-4/h3H,1-2H3,(H,10,11)
Molecular Structure: (C7H8N2O2) 2,4-Dimethylpyrimidine-5-carboxylicacid;
Properties
Density:1.258 g/cm3
Refractive index:1.558
Specification:

The cas register number of 2,4-Dimethylpyrimidine-5-carboxylic acid is 74356-36-8. It also can be called as 5-Pyrimidinecarboxylicacid, 2,4-dimethyl- and the IUPAC Name about this chemical is 2,4-dimethylpyrimidine-5-carboxylic acid. It belongs to the following product categories, such as Carboxylicacid, pharmacetical, Pyrimidine series, Carboxylic Acids, Pyrazines, Pyrimidines & Pyridazines, Carboxylic Acids, Pyrazines, Pyrimidines & Pyridazines, Pyrimidine and so on.

Physical properties about 2,4-Dimethylpyrimidine-5-carboxylic acid are: (1)ACD/LogP: 0.59; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 4; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 63.08Å2; (10)Index of Refraction: 1.558; (11)Molar Refractivity: 39.015 cm3; (12)Molar Volume: 120.961 cm3; (13)Polarizability: 15.467x10-24cm3; (14)Surface Tension: 57.428 dyne/cm; (15)Enthalpy of Vaporization: 56.985 kJ/mol; (16)Boiling Point: 299.627 °C at 760 mmHg; (17)Vapour Pressure: 0.001 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1c(cnc(n1)C)C(=O)O
(2)InChI: InChI=1/C7H8N2O2/c1-4-6(7(10)11)3-8-5(2)9-4/h3H,1-2H3,(H,10,11)
(3)InChIKey: FEFGZJBHDQRFOS-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C7H8N2O2/c1-4-6(7(10)11)3-8-5(2)9-4/h3H,1-2H3,(H,10,11)
(5)Std. InChIKey: FEFGZJBHDQRFOS-UHFFFAOYSA-N

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