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15793-78-9 molecular structure
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3-hydrazinylquinoline

ChemBase ID: 180346
Molecular Formular: C9H9N3
Molecular Mass: 159.18786
Monoisotopic Mass: 159.0796473
SMILES and InChIs

SMILES:
n1cc(cc2ccccc12)NN
Canonical SMILES:
NNc1cnc2c(c1)cccc2
InChI:
InChI=1S/C9H9N3/c10-12-8-5-7-3-1-2-4-9(7)11-6-8/h1-6,12H,10H2
InChIKey:
IISWOHCLTBUICM-UHFFFAOYSA-N

Cite this record

CBID:180346 http://www.chembase.cn/molecule-180346.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
3-hydrazinylquinoline
IUPAC Traditional name
3-hydrazinylquinoline
Synonyms
Quinoline, 3-hydrazino-
CAS Number
15793-78-9
PubChem SID
164236256
PubChem CID
109106

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 109106 external link
Chemik CHH16527 external link Add to cart
Data Source Data ID Price
Chemik
CHH16527 external link Add to cart Please log in.
Data Source Data ID
PubChem 109106 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.3959138  LogD (pH = 7.4) 1.5206985 
Log P 1.5225431  Molar Refractivity 49.686 cm3
Polarizability 19.56157 Å3 Polar Surface Area 50.94 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Bioassay(PubChem)

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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