N-[chloro(phenoxy)phosphoryl]adamantan-1-amine
Basic information
- CAS
53743-46-7- Standard SMILES
O=P(Cl)(NC12CC3CC(CC(C3)C1)C2)Oc1ccccc1- InChIKey
OKLNPZYJBAWOSJ-UHFFFAOYSA-N- Molecular formula
- C16H21ClNO2P
- Average molar mass
- 325.77 g/mol
- Monoisotopic mass
- 325.0998436
Names & identifiers
- Preferred name
- N-[chloro(phenoxy)phosphoryl]adamantan-1-amine
- IUPAC
- N-[chloro(phenoxy)phosphoryl]adamantan-1-amine
Names & synonyms
53743-46-7N-[chloro(phenoxy)phosphoryl]adamantan-1-amineNSC166857DTXSID40304695NSC-166857Phenyl N-(adamantan-1-yl)phosphoramidochloridate
Database identifiers
- CAS
53743-46-7- PubChem CID
- 296599
- DTXSID
DTXSID40304695
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 408
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Compound notes
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