Basic information
- CAS
512-32-3- Standard SMILES
O=P1(N2CC2)NC2CCCC3CCCC(N1)C32- InChIKey
WVGLQHCNUZQBLV-UHFFFAOYSA-N- Molecular formula
- C12H22N3OP
- Average molar mass
- 255.3 g/mol
- Monoisotopic mass
- 255.15004933
Names & identifiers
- Preferred name
- 2-(1-Aziridinyl)-dodecahydronaphtho(1,8-de)-1,3,2-diazaphosphorine 2-oxide
- IUPAC
- 3-(aziridin-1-yl)-2,4-diaza-3λ5-phosphatricyclo[7.3.1.05,13]tridecane 3-oxide
Names & synonyms
2-(1-Aziridinyl)-dodecahydronaphtho(1,8-de)-1,3,2-diazaphosphorine 2-oxide512-32-31H-NAPHTHO(1,8-de)-1,3,2-DIAZAPHOSPHORINE, 2-(1-AZIRIDINYL)DODECAHYDRO-, 2-OXIDE1H-Naphtho[1,8-de]-1,3,2-diazaphosphorine, 2-(1-aziridinyl)dodecahydro-, 2-oxideDipierino-phosphoric acid ethylenimine2-(1-Aziridinyl)dodecahydro-1H-naphtho(1,8-de)-1,3,2-diazaphosphorine 2-oxide62QM7F8LKJDTXSID209654652-(Aziridin-1-yl)dodecahydro-1H-2lambda~5~-naphtho[1,8-de][1,3,2]diazaphosphinin-2-one
Database identifiers
- CAS
512-32-3- PubChem CID
- 10539
- DTXSID
DTXSID20965465- UNII
- 62QM7F8LKJ
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 44.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 347
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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