3-[Bis(aziridin-1-yl)phosphinothioylamino]propan-1-ol
Basic information
- CAS
89851-17-2- Standard SMILES
OCCCNP(=S)(N1CC1)N1CC1- InChIKey
BMHNMQRYNMGYRJ-UHFFFAOYSA-N- Molecular formula
- C7H16N3OPS
- Average molar mass
- 221.26 g/mol
- Monoisotopic mass
- 221.07517031
Names & identifiers
- Preferred name
- 3-[Bis(aziridin-1-yl)phosphinothioylamino]propan-1-ol
- IUPAC
- 3-[bis(aziridin-1-yl)phosphinothioylamino]propan-1-ol
Names & synonyms
89851-17-23-[bis(aziridin-1-yl)phosphinothioylamino]propan-1-olNSC64346NCIOpen2_002967DTXSID10328883NSC-64346P,P-Bis(aziridin-1-yl)-N-(3-hydroxypropyl)phosphinothioic amide
Database identifiers
- CAS
89851-17-2- PubChem CID
- 414801
- DTXSID
DTXSID10328883
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 70.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 214
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Compound notes
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