2-Thiophenecarbonitrile,3-chloro- supplier

Name
3-Chloro-2-Cyanothiophene
EINECS
CAS No. 147123-67-9
Article Data5
CAS DataBase
Density 1.42 g/cm³
Solubility
Melting Point
Formula C₅H₂ClNS
Boiling Point 243.7 °C at 760 mmHg
Molecular Weight 143.5941
Flash Point 101.2 °C
Transport Information
Appearance
Safety 26-36
Risk Codes 22-37/38-41-43
Molecular Structure
Hazard Symbols Xn
Synonyms 3-Chlorothiophene-2-carbonitrile;3-Chloro-2-cyanothiophene;
PSA 52.03000
LogP 2.27318

2-Thiophenecarbonitrile,3-chloro- Specification

The 2-Thiophenecarbonitrile,3-chloro- is an organic compound with the formula C₅H₂ClNS. The systematic name of this chemical is 3-Chlorothiophene-2-carbonitrile. With the CAS registry number 147123-67-9, it is also named as 3-Chloro-2-cyanothiophene. The category of the product is Nitrile. Besides, its molecular weight is 143.5941.

The physical properties of 2-Thiophenecarbonitrile,3-chloro- are: (1)ACD/LogP: 1.89; (2)ACD/LogD (pH 5.5): 1.89; (3)ACD/LogD (pH 7.4): 1.89; (4)ACD/BCF (pH 5.5): 16.09; (5)ACD/BCF (pH 7.4): 16.09; (6)ACD/KOC (pH 5.5): 254.2; (7)ACD/KOC (pH 7.4): 254.2; (8)#H bond acceptors: 1; (9)Polar Surface Area: 52.03 Å²; (10)Index of Refraction: 1.593; (11)Molar Refractivity: 34.28 cm³; (12)Molar Volume: 101 cm³; (13)Polarizability: 13.59×10^-24 cm³; (14)Surface Tension: 54.8 dyne/cm; (15)Density: 1.42 g/cm³; (16)Flash Point: 101.2 °C; (17)Enthalpy of Vaporization: 48.07 kJ/mol; (18)Boiling Point: 243.7 °C at 760 mmHg; (19)Vapour Pressure: 0.0316 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: N#Cc1sccc1Cl
(2)InChI: InChI=1/C5H2ClNS/c6-4-1-2-8-5(4)3-7/h1-2H
(3)InChIKey: FPGDDWCTBDGPAD-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C5H2ClNS/c6-4-1-2-8-5(4)3-7/h1-2H
(5)Std. InChIKey: FPGDDWCTBDGPAD-UHFFFAOYSA-N

Product Name

3-Chloro-2-Cyanothiophene

2-Thiophenecarbonitrile,3-chloro- Specification

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