1H-Azepin-4-amine,hexahydro- supplier

Name
1H-AZEPIN-4-AMINE, HEXAHYDRO-
EINECS
CAS No. 108724-15-8
Density 0.893 g/cm³
Solubility
Melting Point
Formula C₆H₁₄N₂
Boiling Point 178.3 °C at 760 mmHg
Molecular Weight 114.191
Flash Point 67.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Hexamethylenimine,4-amino- (6CI);
PSA
LogP

1H-Azepin-4-amine,hexahydro- Specification

This chemical is called 1H-Azepin-4-amine,hexahydro-, and its systematic name is Azepan-4-amine. With the molecular formula of C₆H₁₄N₂, its molecular weight is 114.19. The CAS registry number of the chemical is 108724-15-8.

Other characteristics of 1H-Azepin-4-amine,hexahydro- can be summarised as followings: (1)ACD/LogP: -0.03; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -4.13; (4)ACD/LogD (pH 7.4): -4.05; (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: 3; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 6.48 Å²; (13)Index of Refraction: 1.453; (14)Molar Refractivity: 34.57 cm³; (15)Molar Volume: 127.7 cm³; (16)Polarizability: 13.7×10^-24cm³; (17)Surface Tension: 31.5 dyne/cm; (18)Density: 0.893 g/cm³; (19)Flash Point: 67.7 °C; (20)Enthalpy of Vaporization: 41.46 kJ/mol; (21)Boiling Point: 178.3 °C at 760 mmHg; (22)Vapour Pressure: 0.996 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: NC1CCCNCC1
2.InChI: InChI=1/C6H14N2/c7-6-2-1-4-8-5-3-6/h6,8H,1-5,7H2
3.InChIKey: ZRNRPJNPCUSWGU-UHFFFAOYAD
4.Std. InChI: InChI=1S/C6H14N2/c7-6-2-1-4-8-5-3-6/h6,8H,1-5,7H2
5.Std. InChIKey: ZRNRPJNPCUSWGU-UHFFFAOYSA-N

Product Name

1H-AZEPIN-4-AMINE, HEXAHYDRO-

1H-Azepin-4-amine,hexahydro- Specification

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