3-Pyridinecarbonitrile,2-amino-5-methyl- supplier

Name
2-AMINO-5-METHYLNICOTINONITRILE
EINECS
CAS No. 38076-78-7
Article Data11
CAS DataBase
Density 1.184g/cm³
Solubility
Melting Point
Formula C₇H₇N₃
Boiling Point 310.56 °C at 760 mmHg
Molecular Weight 133.153
Flash Point 141.622 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Amino-5-methylnicotinonitrile;
PSA 62.70000
LogP 1.42508

3-Pyridinecarbonitrile,2-amino-5-methyl- Specification

The 3-Pyridinecarbonitrile,2-amino-5-methyl-, with CAS registry number 38076-78-7, belongs to the following product category: Pyridine. It has the systematic name of 2-amino-5-methylpyridine-3-carbonitrile. And the chemical formula of this chemical is C₇H₇N₃.

Physical properties of 3-Pyridinecarbonitrile,2-amino-5-methyl-: (1)ACD/LogP: 1.23; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 16; (6)ACD/BCF (pH 7.4): 16; (7)ACD/KOC (pH 5.5): 251; (8)ACD/KOC (pH 7.4): 252; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 62.7 Å²; (13)Index of Refraction: 1.579; (14)Molar Refractivity: 37.359 cm³; (15)Molar Volume: 112.465 cm³; (16)Polarizability: 14.81×10^-24cm³; (17)Surface Tension: 61.383 dyne/cm; (18)Density: 1.184 g/cm³; (19)Flash Point: 141.622 °C; (20)Enthalpy of Vaporization: 55.14 kJ/mol; (21)Boiling Point: 310.56 °C at 760 mmHg; (22)Vapour Pressure: 0.001 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: N#Cc1cc(C)cnc1N
(2)InChI: InChI=1/C7H7N3/c1-5-2-6(3-8)7(9)10-4-5/h2,4H,1H3,(H2,9,10)
(3)InChIKey: OOKFORLRLLVDOD-UHFFFAOYAU
(4)Std. InChI: InChI=1S/C7H7N3/c1-5-2-6(3-8)7(9)10-4-5/h2,4H,1H3,(H2,9,10)
(5)Std. InChIKey: OOKFORLRLLVDOD-UHFFFAOYSA-N

Product Name

2-AMINO-5-METHYLNICOTINONITRILE

3-Pyridinecarbonitrile,2-amino-5-methyl- Specification

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