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2-Thiophenecarbonitrile

CAS number：1003-31-2    molecular formula：C5H3NS

overview
Specs
numbering system
physicochemical properties
Safety information
Production methods and uses
Related
MSDS
related products

overview

compound introduction

Specs

Chinese alias-
English alias2-Cyanothiophene
CAS number1003-31-2molecular formulaC5H3NS
molecular weight109.15Exact mass-
PSA-logp-

numbering system

CAS1003-31-2
WikidataQ72508810
ChEMBL IDCHEMBL2229531
PubChem CID66087
Nikkaji NumberJ147.941E
DSSTox Substance IDDTXSID10143114
Metabolomics Workbench ID127417
European Community (EC) Number213-706-0
PubChem Reference Collection SID500732882

physicochemical properties

XLogP31.3
Complexity102
Exact Mass108.99862027
Formal Charge0
Heavy Atom Count7
Molecular Weight109.15
Monoisotopic Mass108.99862027
Isotope Atom Count0
Rotatable Bond Count0
Hydrogen Bond Donor Count0
Covalently-Bonded Unit Count1
Hydrogen Bond Acceptor Count2
Topological Polar Surface Area52 Ų
Defined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Atom Stereocenter Count0
Undefined Bond Stereocenter Count0

Safety information

Hazard Classes and Categories：
STOT SE 3 (90%)

Production methods and uses

No production method and use information yet

Related

upstream information

No upstream information yet

downstream information

No downstream information yet

MSDS

Found 1 shareMSDS
1003-31-2 | 2-Thiophenecarbonitrile.pdf