1H-Azepin-3-amine,hexahydro-N-methyl- supplier

Name
AZEPAN-3-YL-METHYL-AMINE
EINECS
CAS No. 124695-93-8
Density 0.9 g/cm³
Solubility
Melting Point
Formula C₇H₁₆N₂
Boiling Point 184.4 °C at 760 mmHg
Molecular Weight 128.22
Flash Point 64.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms N-Methylazepan-3-amine;Azepan-3-yl-methyl-amine;
PSA 24.06000
LogP 1.06760

1H-Azepin-3-amine,hexahydro-N-methyl- Specification

The 1H-Azepin-3-amine,hexahydro-N-methyl-, with the CAS registry number 124695-93-8, is also known as Azepan-3-yl-methyl-amine. This chemical's molecular formula is C₇H₁₆N₂ and molecular weight is 128.22. What's more, its systematic name is N-methylazepan-3-amine.

Physical properties of 1H-Azepin-3-amine,hexahydro-N-methyl- are: (1)ACD/LogP: 0.21; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.7; (4)ACD/LogD (pH 7.4): -2.82; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 6.48 Å²; (13)Index of Refraction: 1.471 ; (14)Molar Refractivity: 39.68 cm³; (15)Molar Volume: 141.8 cm³; (16)Polarizability: 15.73×10^-24cm³; (17)Surface Tension: 31.2 dyne/cm; (18)Density: 0.9 g/cm³; (19)Flash Point: 64.9 °C; (20)Enthalpy of Vaporization: 42.06 kJ/mol; (21)Boiling Point: 184.4 °C at 760 mmHg; (22)Vapour Pressure: 0.736 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: N(C)C1CCCCNC1
(2)InChI: InChI=1S/C7H16N2/c1-8-7-4-2-3-5-9-6-7/h7-9H,2-6H2,1H3
(3)InChIKey: OROOBNKHDZYDFL-UHFFFAOYSA-N

Product Name

AZEPAN-3-YL-METHYL-AMINE

1H-Azepin-3-amine,hexahydro-N-methyl- Specification

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