N(2)-Benzyl-5-methyl-1,3,2-dioxaphosphinane-2,5-diamine 2-oxide
Basic information
- CAS
46762-88-3- Standard SMILES
CC1(N)COP(=O)(NCc2ccccc2)OC1- InChIKey
ZPUBXQKRZFHQIS-UHFFFAOYSA-N- Molecular formula
- C11H17N2O3P
- Average molar mass
- 256.24 g/mol
- Monoisotopic mass
- 256.09767941
Names & identifiers
- Preferred name
- N(2)-Benzyl-5-methyl-1,3,2-dioxaphosphinane-2,5-diamine 2-oxide
- IUPAC
- 2-N-benzyl-5-methyl-2-oxo-1,3,2λ5-dioxaphosphinane-2,5-diamine
Names & synonyms
46762-88-3NSC108623NSC 108623N(2)-Benzyl-5-methyl-1,3,2-dioxaphosphinane-2,5-diamine 2-oxideDTXSID001969373-Cyanophenyl isothiocyanate, 97%NSC-108623N~2~-Benzyl-5-methyl-1,3,2-dioxaphosphinane-2,5-diamine 2-oxide5-Amino-2-(benzylamino)-5-methyl-1,3,2lambda~5~-dioxaphosphinan-2-oneN2-benzyl-5-methyl-2-oxo-1,3,2$l^{5}-dioxaphosphinane-2,5-diamine
Database identifiers
- CAS
46762-88-3- PubChem CID
- 268441
- DTXSID
DTXSID00196937
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 73.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 293
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Compound notes
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