N-4-azido-2-nitrophenylpyridoxyl-5-phosphate
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Basic information
- CAS
95973-32-3- Standard SMILES
Cc1ncc(CO)c(CNc2ccc(N=[N+]=[N-])cc2[N+](=O)[O-])c1O- InChIKey
KQPKMEYBZUPZGK-UHFFFAOYSA-N- Molecular formula
- C14H14N6O4
- Average molar mass
- 330.3 g/mol
- Monoisotopic mass
- 330.10765295
Overview
photolabeling reagent
Names & identifiers
- Preferred name
- N-4-azido-2-nitrophenylpyridoxyl-5-phosphate
- IUPAC
- 4-[(4-azido-2-nitroanilino)methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol
- English name
- N-4-azido-2-nitrophenylpyridoxyl-5-phosphate
- Molecular formula
- C14H15N6O7P
- Molecular weight
- 410.28
Names & synonyms
N-4-Azido-2-nitrophenylpyridoxyl-5-phosphate95973-32-3DTXSID302420523-Pyridinemethanol, 4-(((4-azido-2-nitrophenyl)amino)methyl)-5-hydroxy-6-methyl-, cis-(+-)-RefChem:162493DTXCID301645434-[(4-azido-2-nitroanilino)methyl]-5-(hydroxymethyl)-2-methylpyridin-3-olNANP
Database identifiers
- CAS
95973-32-3- PubChem CID
- 3036459
- DTXSID
DTXSID30242052
Properties
Computed structural propertiesFilling in
- XLogP
- 2.8
- Topological polar surface area
- 126 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 480
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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