Basic information
- CAS
41657-31-2- Standard SMILES
C=CCN(CC=C)P(=S)(N1CC1C)N1CC1C- InChIKey
MRIGPWDOYZZKMI-UHFFFAOYSA-N- Molecular formula
- C12H22N3PS
- Average molar mass
- 271.36 g/mol
- Monoisotopic mass
- 271.12720589
Names & identifiers
- Preferred name
- Phosphine sulfide, bis(2-methyl-1-aziridinyl)diallylamino-
- IUPAC
- N-bis(2-methylaziridin-1-yl)phosphinothioyl-N-prop-2-enylprop-2-en-1-amine
- English name
- Bis(2-methyl-1-aziridinyl)(diallylamino)phosphine sulfide
- Molecular weight
- 0
Names & synonyms
41657-31-2NSC 93107Phosphine sulfide, bis(2-methyl-1-aziridinyl)diallylamino-AI3-61572Bis(2-methyl-1-aziridinyl)diallylaminophosphine sulfidePhosphinothioic amide, P,P-bis(2-methyl-1-aziridinyl)-N,N-di-2-propenyl-RefChem:370080Phosphinothioic amide, P,P-bis(2-methyl-1-aziridinyl)-N,N-di-2-propenyl-(9CI)NSC93107CHEMBL3277082SCHEMBL21906277DTXSID80961882
Show more names
Bis(2-methyl-1-aziridinyl)(diallylamino)phosphine sulfide
NSC-93107Phosphinothioic amide,P-bis(2-methyl-1-aziridinyl)-N,N-di-2-propenyl-P,P-Bis(2-methylaziridin-1-yl)-N,N-di(prop-2-en-1-yl)phosphinothioic amideP,P-Bis[(2-methylaziridin-1-yl)]-N,N-diprop-2-en-1-ylphosphinothioic amide
Database identifiers
- CAS
41657-31-2- PubChem CID
- 96908
- DTXSID
DTXSID80961882- ChEMBL
CHEMBL3277082- Nikkaji
- J85.564B
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 41.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 341
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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