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CAS No.: | 933741-93-6 |
---|---|
Name: | 4-Amino-1-methyl-hexahydro-1H-azepine |
Molecular Structure: | |
Formula: | C7H16N2 |
Molecular Weight: | 128.2153 |
Synonyms: | 1H-azepin-4-amine, hexahydro-1-methyl-; |
Density: | 0.898 g/cm3 |
Boiling Point: | 162.27 °C at 760 mmHg |
Flash Point: | 51.412 °C |
PSA: | 29.26000 |
LogP: | 1.06760 |
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The 1-Methylazepan-4-amine, with the CAS registry number 933741-93-6, is also known as 1H-Azepin-4-amine, hexahydro-1-methyl-. This chemical's molecular formula is C7H16N2 and molecular weight is 128.21534. Its systematic name is called 1-methylazepan-4-amine.
Physical properties of 1-Methylazepan-4-amine: (1)ACD/LogP: 0.80; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 2; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 1; (9)Index of Refraction: 1.465; (10)Molar Refractivity: 39.498 cm3; (11)Molar Volume: 142.818 cm3; (12)Surface Tension: 30.197 dyne/cm; (13)Density: 0.898 g/cm3; (14)Flash Point: 51.412 °C; (15)Enthalpy of Vaporization: 39.884 kJ/mol; (16)Boiling Point: 162.27 °C at 760 mmHg; (17)Vapour Pressure: 2.184 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CN1CCCC(CC1)N
(2)InChI: InChI=1/C7H16N2/c1-9-5-2-3-7(8)4-6-9/h7H,2-6,8H2,1H3
(3)InChIKey: LYRZFDLVKYYDOX-UHFFFAOYAW