-
Name
N,N'-DIBENZYLBUTANE-1,4-DIAMINE
- EINECS
- CAS No. 31719-05-8
- Article Data11
- CAS DataBase
- Density 1.006 g/cm3
- Solubility
- Melting Point 65 °C
- Formula C18H24N2
- Boiling Point 401.5 °C at 760 mmHg
- Molecular Weight 268.402
- Flash Point 235.7 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms 1,4-Butanediamine,N,N'-bis(phenylmethyl)- (9CI);1,4-Butanediamine, N,N'-dibenzyl- (7CI,8CI);N,N'-Bis(phenylmethyl)-1,4-butanediamine;N,N'-Dibenzyl-1,4-butanediamine;N,N'-Dibenzylputrescine;N,N'-Dibenzyltetramethylenediamine;NSC 62400;
- PSA 24.06000
- LogP 4.12800
1,4-Butanediamine,N1,N4-bis(phenylmethyl)- Specification
The 1,4-Butanediamine,N1,N4-bis(phenylmethyl)- is an organic compound with the formula C18H24N2. The systematic name of this chemical is N,N'-Dibenzylbutane-1,4-diamine. The CAS registry number of this chemical is 31719-05-8. Besides, its molecular weight is 268.40.
The physical properties of 1,4-Butanediamine,N1,N4-bis(phenylmethyl)- are: (1)ACD/LogP: 3.65; (2)#H bond acceptors: 2; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 9; (5)Polar Surface Area: 6.48 Å2; (6)Index of Refraction: 1.558; (7)Molar Refractivity: 86.01 cm3; (8)Molar Volume: 266.6 cm3; (9)Polarizability: 34.09×10-24 cm3; (10)Surface Tension: 40.1 dyne/cm; (11)Density: 1.006 g/cm3; (12)Flash Point: 235.7 °C; (13)Enthalpy of Vaporization: 65.25 kJ/mol; (14)Boiling Point: 401.5 °C at 760 mmHg; (15)Vapour Pressure: 1.17E-06 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: N(CCCCNCc1ccccc1)Cc2ccccc2
(2)InChI: InChI=1/C18H24N2/c1-3-9-17(10-4-1)15-19-13-7-8-14-20-16-18-11-5-2-6-12-18/h1-6,9-12,19-20H,7-8,13-16H2
(3)InChIKey: IXBTYWVCTCYLJR-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C18H24N2/c1-3-9-17(10-4-1)15-19-13-7-8-14-20-16-18-11-5-2-6-12-18/h1-6,9-12,19-20H,7-8,13-16H2
(5)Std. InChIKey: IXBTYWVCTCYLJR-UHFFFAOYSA-N
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