Basic information
- CAS
127755-08-2- Standard SMILES
NCc1ccccc1.O=P(O)(O)O- InChIKey
OGEDOBZILFEBDN-UHFFFAOYSA-N- Molecular formula
- C7H12NO4P
- Average molar mass
- 205.15 g/mol
- Monoisotopic mass
- 205.05039486
Names & identifiers
- Preferred name
- Benzenemethanamine, phosphate (1:1)
- IUPAC
- phenylmethanamine;phosphoric acid
Names & synonyms
127755-08-2Benzenemethanamine, phosphate (1:1)NSC150120SCHEMBL7933802DTXSID90302308NSC-150120Phosphoric acid--1-phenylmethanamine (1/1)
Database identifiers
- CAS
127755-08-2- PubChem CID
- 288779
- DTXSID
DTXSID90302308
Properties
Computed structural properties
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 105
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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