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N-(4-Bromophenyl)propanehydrazonic acid

HCID 769159
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Basic information

CAS
42095-80-7
Standard SMILES
CCC(=O)NNc1ccc(Br)cc1
InChIKey
QJWLIGNFPMIGKX-UHFFFAOYSA-N
Molecular formula
C9H11BrN2O
Average molar mass
243.1 g/mol
Monoisotopic mass
242.00548

Names & identifiers

Preferred name
N-(4-Bromophenyl)propanehydrazonic acid
IUPAC
N'-(4-bromophenyl)propanehydrazide
English name
Propionic acid 2-(p-bromophenyl)hydrazide
Molecular formula
C9H11BrN2O
Molecular weight
243.10044

Names & synonyms

42095-80-7DTXSID60962271N-(4-Bromophenyl)propanehydrazonic acidRefChem:1091258DTXCID901390081N'-(4-bromophenyl)propanohydrazideZINC249623Propionic acid 2-(p-bromophenyl)hydrazideN'-(4-bromophenyl)propanehydrazideBRN 4996826Propionic acid, 2-(p-bromophenyl)hydrazideCCC(=O)NNc1ccc(cc1)Br
Show more names
CBDivE_001762MLS000720152CHEMBL1578291HMS2608P24CCC(=O)NNC1=CC=C(C=C1)BrMFCD00456243STK005720ZINC00249623

Database identifiers

CAS
42095-80-7
PubChem CID
769159
DTXSID
DTXSID60962271
ChEMBL
CHEMBL1578291
Nikkaji
J92.639F

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
41.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
13
Formal charge
0
Complexity
167

Related reactions

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Compound notes

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