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215778-63-5 molecular structure
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6-bromo-2-methylquinoline-4-carbohydrazide

ChemBase ID: 310762
Molecular Formular: C11H10BrN3O
Molecular Mass: 280.1206
Monoisotopic Mass: 279.00072396
SMILES and InChIs

SMILES:
c1(c2c(nc(c1)C)ccc(c2)Br)C(=O)NN
Canonical SMILES:
NNC(=O)c1cc(C)nc2c1cc(Br)cc2
InChI:
InChI=1S/C11H10BrN3O/c1-6-4-9(11(16)15-13)8-5-7(12)2-3-10(8)14-6/h2-5H,13H2,1H3,(H,15,16)
InChIKey:
LEBFGWOGYMQWIX-UHFFFAOYSA-N

Cite this record

CBID:310762 http://www.chembase.cn/molecule-310762.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
6-bromo-2-methylquinoline-4-carbohydrazide
IUPAC Traditional name
6-bromo-2-methylquinoline-4-carbohydrazide
Synonyms
6-bromo-2-methylquinoline-4-carbohydrazide
CAS Number
215778-63-5
MDL Number
MFCD00115250

DATA SOURCES

DATA SOURCES

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Data Source Data ID
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Data Source Data ID Price
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Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.5840435  LogD (pH = 7.4) 1.5851734 
Log P 1.5851879  Molar Refractivity 65.7561 cm3
Polarizability 25.70593 Å3 Polar Surface Area 68.01 Å2

PROPERTIES

PROPERTIES

Bioassay(PubChem)

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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