Basic information
- CAS
6783-73-9- Standard SMILES
N#CCCP(=S)(CCC#N)CCC#N- InChIKey
YHGRWKREYGXJFH-UHFFFAOYSA-N- Molecular formula
- C9H12N3PS
- Average molar mass
- 225.25 g/mol
- Monoisotopic mass
- 225.04895557
Names & identifiers
- Preferred name
- Phosphine sulfide, tris(2-cyanoethyl)-
- IUPAC
- 3-[bis(2-cyanoethyl)phosphinothioyl]propanenitrile
- English name
- Tris(2-cyanoethyl)phosphine sulfide
- Molecular formula
- C9H12N3PS
- Molecular weight
- 225.25
Names & synonyms
Tris(2-cyanoethyl)phosphine sulfidePhosphine sulfide, tris(2-cyanoethyl)-NSC 222431BRN 1708706Propanenitrile, 3,3',3''-phosphinothioylidynetris-DTXSID702180744-04-00-03469 (Beilstein Handbook Reference)RefChem:370085DTXCID90140565Propanenitrile, 3,3',3''-phosphinothioylidynetris-(9CI)6783-73-93,3',3''-phosphorothioyltripropanenitrile
Show more names
Propanenitrile, 3,3',3''-phosphinothioylidynetris- (9CI)
NSC222431SCHEMBL8466766WLN: SP2CN&2CN&2CNNSC-222431Propanenitrile,3',3''-phosphinothioylidynetris-
Database identifiers
- CAS
6783-73-9- PubChem CID
- 99397
- DTXSID
DTXSID70218074- Nikkaji
- J50.232D
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 304
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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