CAS No.69783-31-9,3,4-DIMETHOXY-BENZAMIDINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	69783-31-9
Name:	3,4-DIMETHOXY-BENZAMIDINE
Article Data:	3

Formula:	C₉H₁₂N₂O₂
Molecular Weight:	180.206
Synonyms:	3,4-Dimethoxybenzamidine;3,4-dimethoxybenzimidamide;
Density:	1.17 g/cm³
Boiling Point:	290.4 °C at 760 mmHg
Flash Point:	129.4 °C
PSA:	68.33000
LogP:	1.78790

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Specification

The CAS register number of Benzenecarboximidamide,3,4-dimethoxy- is 69783-31-9. It also can be called as 3,4-Dimethoxybenzamidine and the IUPAC name about this chemical is 3,4-dimethoxybenzenecarboximidamide. The molecular formula about this chemical is C₉H₁₂N₂O₂ and the molecular weight is 180.2. It belongs to the following product category which includes pharmacetical.

Physical properties about Benzenecarboximidamide,3,4-dimethoxy- are: (1)ACD/LogP: 0.89; (2)ACD/LogD (pH 5.5): -1.11; (3)ACD/LogD (pH 7.4): -1.11; (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): 1; (8)#H bond acceptors: 4; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 34.06 Å²; (12)Index of Refraction: 1.532; (13)Molar Refractivity: 47.7 cm³; (14)Molar Volume: 153.7 cm³; (15)Polarizability: 18.91x10^-24cm³; (16)Surface Tension: 39.2 dyne/cm; (17)Density: 1.17 g/cm³; (18)Flash Point: 129.4 °C; (19)Enthalpy of Vaporization: 52.97 kJ/mol; (20)Boiling Point: 290.4 °C at 760 mmHg; (21)Vapour Pressure: 0.00208 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: O(c1ccc(cc1OC)C(=[N@H])N)C
(2)InChI: InChI=1/C9H12N2O2/c1-12-7-4-3-6(9(10)11)5-8(7)13-2/h3-5H,1-2H3,(H3,10,11)
(3)InChIKey: GRNBGCVJIQHIKG-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C9H12N2O2/c1-12-7-4-3-6(9(10)11)5-8(7)13-2/h3-5H,1-2H3,(H3,10,11)
(5)Std. InChIKey: GRNBGCVJIQHIKG-UHFFFAOYSA-N