Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
3-(Aminomethyl)-N,N-dimethyltetrahydrothiophen-3-amine |
EINECS | N/A |
CAS No. | 176445-79-7 | Density | 1.06 /cm3 |
PSA | 54.56000 | LogP | 1.08270 |
Solubility | N/A | Melting Point |
N/A |
Formula | C7H16N2S | Boiling Point | 244.8 °C at 760 mmHg |
Molecular Weight | 160.283 | Flash Point | 101.9 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes |
C:Corrosive; |
|
Molecular Structure | Hazard Symbols | R34:Causes burns.; | |
Synonyms |
3-(AMINOMETHYL)-N,N-DIMETHYLTETRAHYDRO-3-THIOPHENAMINE;3-(Aminomethyl)-N,N-dimethyltetrahydrothiophen-3-amine |
Article Data | 1 |
The cas register number of 3-(Aminomethyl)-N,N-dimethyltetrahydrothiophen-3-amine is 176445-79-7. The Systematic name about this chemical is 3-(aminomethyl)-N,N-dimethyltetrahydrothiophen-3-amine. The Molecular Formula about this chemical is C7H16N2S.
Physical properties about 3-(Aminomethyl)-N,N-dimethyltetrahydrothiophen-3-amine are: (1)ACD/LogP: 0.21; (2)ACD/LogD (pH 5.5): -3.72; (3)ACD/LogD (pH 7.4): -2.63; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 31.78Å2; (12)Index of Refraction: 1.549; (13)Molar Refractivity: 47.93 cm3; (14)Molar Volume: 150.6 cm3; (15)Polarizability: 19x0-24cm3; (16)Surface Tension: 42.8 dyne/cm; (17)Enthalpy of Vaporization: 48.19 kJ/mol; (18)Boiling Point: 244.8 °C at 760 mmHg; (19)Vapour Pressure: 0.0297 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: S1CCC(N(C)C)(CN)C1
(2)InChI: InChI=1/C7H16N2S/c1-9(2)7(5-8)3-4-10-6-7/h3-6,8H2,1-2H3
(3)InChIKey: QSPJOBDYLWKZPW-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C7H16N2S/c1-9(2)7(5-8)3-4-10-6-7/h3-6,8H2,1-2H3
(5)Std. InChIKey: QSPJOBDYLWKZPW-UHFFFAOYSA-N