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68500-35-6 molecular structure
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4-hydrazinyl-8-methylquinoline

ChemBase ID: 309659
Molecular Formular: C10H11N3
Molecular Mass: 173.21444
Monoisotopic Mass: 173.09529737
SMILES and InChIs

SMILES:
c12c(nccc1NN)c(ccc2)C
Canonical SMILES:
NNc1ccnc2c1cccc2C
InChI:
InChI=1S/C10H11N3/c1-7-3-2-4-8-9(13-11)5-6-12-10(7)8/h2-6H,11H2,1H3,(H,12,13)
InChIKey:
SUSYTHMNOJICKQ-UHFFFAOYSA-N

Cite this record

CBID:309659 http://www.chembase.cn/molecule-309659.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
4-hydrazinyl-8-methylquinoline
IUPAC Traditional name
4-hydrazinyl-8-methylquinoline
Synonyms
4-hydrazino-8-methylquinoline
CAS Number
68500-35-6
MDL Number
MFCD00272470

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.0742315  LogD (pH = 7.4) 2.0052335 
Log P 2.0359645  Molar Refractivity 54.7272 cm3
Polarizability 21.32515 Å3 Polar Surface Area 50.94 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Product Information Bioassay(PubChem)
Purity
98% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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