Basic information
- CAS
61500-12-7- Standard SMILES
CCOP(=O)(Nc1nc2ccccc2[nH]1)OCC- InChIKey
KWLSGYGLZGECCI-UHFFFAOYSA-N- Molecular formula
- C11H16N3O3P
- Average molar mass
- 269.24 g/mol
- Monoisotopic mass
- 269.09292838
Names & identifiers
- Preferred name
- Diethyl N-1H-benzimidazol-2-ylphosphoramidate
- IUPAC
- N-diethoxyphosphoryl-1H-benzimidazol-2-amine
Names & synonyms
61500-12-7NSC227391Diethyl N-1H-benzimidazol-2-ylphosphoramidateSCHEMBL22638071DTXSID40310478NSC-227391diethyl 1H-benzimidazol-2-ylamidophosphateAG-690/36391014Diethyl N-(1H-1,3-benzimidazol-2-yl)phosphoramidatePhosphoramidic acid, N-1H-benzimidazol-2-yl-, diethyl ester
Database identifiers
- CAS
61500-12-7- PubChem CID
- 313448
- DTXSID
DTXSID40310478
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 76.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 306
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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