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162104269 molecular structure
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6-hydrazinylquinoline dihydrochloride

ChemBase ID: 72212
Molecular Formular: C9H11Cl2N3
Molecular Mass: 232.10974
Monoisotopic Mass: 231.03300273
SMILES and InChIs

SMILES:
c1cnc2c(c1)cc(cc2)NN.Cl.Cl
Canonical SMILES:
NNc1ccc2c(c1)cccn2.Cl.Cl
InChI:
InChI=1S/C9H9N3.2ClH/c10-12-8-3-4-9-7(6-8)2-1-5-11-9;;/h1-6,12H,10H2;2*1H
InChIKey:
WWUVKHLYLOXKLJ-UHFFFAOYSA-N

Cite this record

CBID:72212 http://www.chembase.cn/molecule-72212.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
6-hydrazinylquinoline dihydrochloride
IUPAC Traditional name
6-hydrazinylquinoline dihydrochloride
Synonyms
6-Hydrazinoquinoline dihydrochloride
PubChem SID
162104269
PubChem CID
71300026

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Matrix Scientific
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Data Source Data ID
PubChem 71300026 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.2453569  LogD (pH = 7.4) 1.5180826 
Log P 1.5225431  Molar Refractivity 49.686 cm3
Polarizability 19.562153 Å3 Polar Surface Area 50.94 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Bioassay(PubChem)
Storage Warning
IRRITANT expand Show data source
MSDS Link
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DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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