Pyrazinamine, 6-methoxy- supplier

Name
6-Methoxypyrazinamine
EINECS
CAS No. 6905-47-1
Article Data7
CAS DataBase
Density 1.224 g/cm³
Solubility
Melting Point 112℃ (cyclohexane )
Formula C₅H₇N₃O
Boiling Point 266.1 °C at 760 mmHg
Molecular Weight 125.13
Flash Point 114.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 6-Methoxypyrazin-2-amine;6-Methoxypyrazinamine;2-Pyrazinamine, 6-methoxy-;
PSA 61.03000
LogP 0.64860

Pyrazinamine, 6-methoxy- Specification

The CAS register number of Pyrazinamine, 6-methoxy- is 6905-47-1. It also can be called as 2-Pyrazinamine, 6-methoxy- and the systematic name about this chemical is 6-methoxypyrazin-2-amine. The molecular formula about this chemical is C₅H₇N₃O and the molecular weight is 125.13008.

Physical properties about Pyrazinamine, 6-methoxy- are: (1)ACD/LogP: 1.16; (2)ACD/LogD (pH 5.5): 1.16; (3)ACD/LogD (pH 7.4): 1.16; (4)ACD/BCF (pH 5.5): 4.49; (5)ACD/BCF (pH 7.4): 4.51; (6)ACD/KOC (pH 5.5): 101.95; (7)ACD/KOC (pH 7.4): 102.24; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 38.25 Å²; (12)Index of Refraction: 1.566; (13)Molar Refractivity: 33.35 cm³; (14)Molar Volume: 102.1 cm³; (15)Polarizability: 13.22x10^-24cm³; (16)Surface Tension: 54.8 dyne/cm; (17)Density: 1.224 g/cm³; (18)Flash Point: 114.8 °C; (19)Enthalpy of Vaporization: 50.41 kJ/mol; (20)Boiling Point: 266.1 °C at 760 mmHg; (21)Vapour Pressure: 0.00879 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: O(c1nc(N)cnc1)C
(2)InChI: InChI=1/C5H7N3O/c1-9-5-3-7-2-4(6)8-5/h2-3H,1H3,(H2,6,8)
(3)InChIKey: YGFNVCMGUHJLRU-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C5H7N3O/c1-9-5-3-7-2-4(6)8-5/h2-3H,1H3,(H2,6,8)
(5)Std. InChIKey: YGFNVCMGUHJLRU-UHFFFAOYSA-N

Product Name

6-Methoxypyrazinamine

Pyrazinamine, 6-methoxy- Specification

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