Basic information
- CAS
73606-41-4- Standard SMILES
N#CC#Cc1cccs1- InChIKey
WAAOEURBCIITHE-UHFFFAOYSA-N- Molecular formula
- C7H3NS
- Average molar mass
- 133.17 g/mol
- Monoisotopic mass
- 132.99862027
Names & identifiers
- Preferred name
- 3-(Thiophen-2-YL)prop-2-ynenitrile
- IUPAC
- 3-thiophen-2-ylprop-2-ynenitrile
- English name
- 2-Propynenitrile, 3-(2-thienyl)- (9CI)
- Molecular formula
- C7H3NS
- Molecular weight
- 133.17
Names & synonyms
73606-41-43-(THIOPHEN-2-YL)PROP-2-YNENITRILESCHEMBL2558154DTXSID20501827AKOS0234276332-Propynenitrile, 3-(2-thienyl)-2-Propynenitrile, 3-(2-thienyl)- (9CI)
Database identifiers
- CAS
73606-41-4- PubChem CID
- 12540468
- DTXSID
DTXSID20501827- Nikkaji
- J2.442.494D
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 199
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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