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60547-96-8

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Basic Information
CAS No.: 60547-96-8
Name: 6,7-Dimethoxyquinazoline-2,4-diamine
Article Data: 2
Molecular Structure:
Molecular Structure of 60547-96-8 (6,7-Dimethoxyquinazoline-2,4-diamine)
Formula: C10H12N4O2
Molecular Weight: 220.2279
Synonyms: 6,7-dimethoxyquinazoline-2,4-diamine;
EINECS: 1533716-785-6
Density: 1.354 g/cm3
Boiling Point: 489.8 °C at 760 mmHg
Flash Point: 250 °C
PSA: 97.74000
LogP: 0.67160
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Specification

The CAS registry number of 2,4-Diamino-6,7-dimethoxyquinazoline is 60547-96-8. This chemical's molecular formula is C10H12N4O2 and molecular weight is 220.2279. Its systematic name is called 6,7-dimethoxyquinazoline-2,4-diamine.

Physical properties of 2,4-Diamino-6,7-dimethoxyquinazoline: (1)ACD/LogP: 0.70; (2)ACD/LogD (pH 5.5): -1.66; (3)ACD/LogD (pH 7.4): -0.35; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 5.18; (8)#H bond acceptors: 6; (9)#H bond donors: 4; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.689; (12)Molar Refractivity: 62.1 cm3; (13)Molar Volume: 162.5 cm3; (14)Surface Tension: 66.6 dyne/cm; (15)Density: 1.354 g/cm3; (16)Flash Point: 250 °C; (17)Enthalpy of Vaporization: 75.62 kJ/mol; (18)Boiling Point: 489.8 °C at 760 mmHg; (19)Vapour Pressure: 9.64E-10 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: n2c1c(cc(OC)c(OC)c1)c(nc2N)N
(2)InChI: InChI=1/C10H12N4O2/c1-15-7-3-5-6(4-8(7)16-2)13-10(12)14-9(5)11/h3-4H,1-2H3,(H4,11,12,13,14)
(3)InChIKey: ZCIPYVXKMWNKLZ-UHFFFAOYAI