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Name |
Thiocyanic acid, triaminomethylester |
EINECS | N/A |
CAS No. | 7253-03-4 | Density | 1.477 g/cm3 |
PSA | N/A | LogP | N/A |
Solubility | N/A | Melting Point |
N/A |
Formula | C2H6N4S | Boiling Point | 289.7 °C at 760 mmHg |
Molecular Weight | 118.1608 | Flash Point | 129 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
NSC66330;triaminomethyl thiocyanate; |
The Thiocyanic acid, triaminomethylester, with the CAS registry number 7253-03-4, has the systematic name of triaminomethyl thiocyanate. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C2H6N4S.
The characteristics of Thiocyanic acid, triaminomethylester are as followings: (1)ACD/LogP: 1.48; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 4; (4)#H bond donors: 6; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 58.81 Å2; (7)Index of Refraction: 1.667; (8)Molar Refractivity: 29.79 cm3; (9)Molar Volume: 79.9 cm3; (10)Polarizability: 11.81×10-24cm3; (11)Surface Tension: 99.9 dyne/cm; (12)Density: 1.477 g/cm3; (13)Flash Point: 129 °C; (14)Enthalpy of Vaporization: 52.9 kJ/mol; (15)Boiling Point: 289.7 °C at 760 mmHg; (16)Vapour Pressure: 0.00217 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: N#CSC(N)(N)N
(2)InChI: InChI=1/C2H6N4S/c3-1-7-2(4,5)6/h4-6H2
(3)InChIKey: WTHMPFIIEXIALV-UHFFFAOYAU