Basic information
- CAS
799-87-1- Standard SMILES
COP(=O)(Oc1ccc([N+](=O)[O-])cc1)Oc1ccc([N+](=O)[O-])cc1- InChIKey
QQXGGQAHRFTLCQ-UHFFFAOYSA-N- Molecular formula
- C13H11N2O8P
- Average molar mass
- 354.21 g/mol
- Monoisotopic mass
- 354.02530231
Overview
used as spectrophotometric titrant (inhibitor) for group of serine hydrlases
Names & identifiers
- Preferred name
- Bis(4-nitrophenyl)methyl phosphate
- IUPAC
- methyl bis(4-nitrophenyl) phosphate
- English name
- Ribavirin API Impurity O
- Molecular formula
- C13H11N2O8P
- Molecular weight
- 354.21
Names & synonyms
Bis(4-nitrophenyl)methyl phosphate799-87-1Bis(p-nitrophenyl)methyl phosphateDTXSID40229950Phosphoric acid, methyl bis(4-nitrophenyl) esterRefChem:120157DTXCID90152441methyl bis(4-nitrophenyl) phosphateRibavirin Impurity 10Ribavirin Impurity 42SCHEMBL10411255bis(p-nitrophenyl) methyl phosphate
Show more names
Ribavirin Impurity 61Ribavirin API Impurity OBis(bisnitrophenol) phosphate methyl ester
Database identifiers
- CAS
799-87-1- PubChem CID
- 13112
- DTXSID
DTXSID40229950- Nikkaji
- J643.284K
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 136 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 449
Chemistry & industry
Suppliers5 total
Sinco Pharmachem (ShenZhen) R&D Co., Ltd.+86-18603013401 · [email protected]
杭州云易国科生物科技有限公司18457506494 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
湖北摩科化学有限公司18627753421; 18627756402 · [email protected]
上海择睿生物科技有限公司021-54580889 18321124657 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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