2-Thiophenecarbonitrile

C5H3NSCAS 1003-31-2109.15 g/mol

NS
Nitrile

Properties

Molecular formula
C5H3NS
Molar mass
109.15 g/mol
Exact mass
108.9986 Da
Density
1.18 g/mL (at 16 °C)
Melting point
125–134 °C (decomposes)
Boiling point
192 °C
logP
1.62Crippen estimate
Polar surface area
23.8 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
0

Hazards

Danger
Flammable (GHS02)Corrosive (GHS05)Acute Toxic (GHS06)Irritant (GHS07)

Aggregated from 50 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501

Identifiers

CAS number
1003-31-2
SMILES
N#Cc1cccs1
InChIKey
CUPOOAWTRIURFT-UHFFFAOYSA-N
InChI
InChI=1S/C5H3NS/c6-4-5-2-1-3-7-5/h1-3H

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

5 names
  • 2-Cyanothiophene
  • 2-Thienonitrile
  • 2-Thienylcarbonitrile
  • Thiopheno-2-carbonitrile
  • 2-Thiophenenitrile

Work with 2-Thiophenecarbonitrile

Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue.

Same formula

Elsewhere