Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
(Z)-2-Phenyl-3-thiophen-2-yl-prop-2-enenitrile |
EINECS | N/A |
CAS No. | 72030-16-1 | Density | 1.204 g/cm3 |
PSA | N/A | LogP | N/A |
Solubility | N/A | Melting Point |
N/A |
Formula | C13H9NS | Boiling Point | 341.4 °C at 760 mmHg |
Molecular Weight | 211.287 | Flash Point | 160.2 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
(2Z)-2-phenyl-3-(2-thienyl)-2-propenenitrile;NSC149686; |
Article Data | 2 |
This chemical is called (Z)-2-Phenyl-3-thiophen-2-yl-prop-2-enenitrile, and it can also be named as 2-Phenyl-3-thiophen-2-yl-prop-2-enenitrile. With the molecular formula of C13H9NS, its molecular weight is 211.2823. The CAS registry number of this chemical is 72030-16-1, and its IUPAC name is (Z)-2-phenyl-3-thiophen-2-ylprop-2-enenitrile.
Other characteristics of the (Z)-2-Phenyl-3-thiophen-2-yl-prop-2-enenitrile can be summarised as followings: (1)ACD/LogP: 4.30; (2)#H bond acceptors: 1; (3)#Freely Rotating Bonds: 2; (4)Index of Refraction: 1.666; (5)Molar Refractivity: 65.21 cm3; (6)Molar Volume: 175.3 cm3; (7)Surface Tension: 53.1 dyne/cm; (8)Density: 1.204 g/cm3; (9)Flash Point: 160.2 °C; (10)Enthalpy of Vaporization: 58.5 kJ/mol; (11)Boiling Point: 341.4 °C at 760 mmHg; (12)Vapour Pressure: 8.09E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C(C=C1)C(=CC2=CC=CS2)C#N
(2)Isomeric SMILES: C1=CC=C(C=C1)/C(=C/C2=CC=CS2)/C#N
(3)InChI: InChI=1S/C13H9NS/c14-10-12(9-13-7-4-8-15-13)11-5-2-1-3-6-11/h1-9H/b12-9+
(4)InChIKey: FACDZBYANOZMGQ-FMIVXFBMSA-N