BENZOIC ACID, p-((p-(METHYLHYDROXYAMINO)PHENYL)AZO)-, METHYL ESTER
Basic information
- CAS
55936-78-2- Standard SMILES
COC(=O)c1ccc(N=Nc2ccc(N(C)O)cc2)cc1- InChIKey
MITVXGHRDODYCD-UHFFFAOYSA-N- Molecular formula
- C15H15N3O3
- Average molar mass
- 285.3 g/mol
- Monoisotopic mass
- 285.11134135
Names & identifiers
- Preferred name
- BENZOIC ACID, p-((p-(METHYLHYDROXYAMINO)PHENYL)AZO)-, METHYL ESTER
- IUPAC
- methyl 4-[[4-[hydroxy(methyl)amino]phenyl]diazenyl]benzoate
Names & synonyms
55936-78-2BENZOIC ACID, p-((p-(METHYLHYDROXYAMINO)PHENYL)AZO)-, METHYL ESTERBRN 18437584'-Methoxycarbonyl-N-hydroxy-N-methyl-4-aminoazobenzeneDTXSID301039394Benzoic acid, 4-[2-[4-(hydroxymethylamino)phenyl]diazenyl]-, methyl ester
Database identifiers
- CAS
55936-78-2- PubChem CID
- 41667
- DTXSID
DTXSID301039394- Nikkaji
- J87.842A
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 74.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 359
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Related reactions
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Compound notes
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