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Methyl 4-[2-[4-(dimethylamino)phenyl]diazenyl]benzoate

HCID 4075005
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
24630-00-0
Standard SMILES
COC(=O)c1ccc(N=Nc2ccc(N(C)C)cc2)cc1
InChIKey
JTFDDDDHFROPQU-UHFFFAOYSA-N
Molecular formula
C16H17N3O2
Average molar mass
283.32 g/mol
Monoisotopic mass
283.13207679

Names & identifiers

Preferred name
Methyl 4-[2-[4-(dimethylamino)phenyl]diazenyl]benzoate
IUPAC
methyl 4-[[4-(dimethylamino)phenyl]diazenyl]benzoate

Names & synonyms

24630-00-0Methyl 4-(2-(4-(dimethylamino)phenyl)diazenyl)benzoateMethyl 4-[2-[4-(dimethylamino)phenyl]diazenyl]benzoateRefChem:355332methyl 4-[[4-(dimethylamino)phenyl]diazenyl]benzoateBenzoic acid, 4-[[4-(dimethylamino)phenyl]azo]-, methyl esterMLS001174969SCHEMBL10216153DTXSID40399061AKOS001015719AKOS034452293SMR000595642
Show more names
azobenzene, 4-dimethylamino-4'-methoxycarbonyl-Z56771390T0501-8922Methyl 4-{(E)-[4-(dimethylamino)phenyl]diazenyl}benzoate

Database identifiers

CAS
24630-00-0
PubChem CID
4075005
DTXSID
DTXSID40399061
Nikkaji
J405.688D

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
54.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
21
Formal charge
0
Complexity
355

Related reactions

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Compound notes

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