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203626-36-2 molecular structure
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8-chloro-4-hydrazinyl-2-methylquinoline

ChemBase ID: 816064
Molecular Formular: C10H10ClN3
Molecular Mass: 207.6595
Monoisotopic Mass: 207.05632502
SMILES and InChIs

SMILES:
c1c(c2c(cc1)c(cc(n2)C)NN)Cl
Canonical SMILES:
NNc1cc(C)nc2c1cccc2Cl
InChI:
InChI=1S/C10H10ClN3/c1-6-5-9(14-12)7-3-2-4-8(11)10(7)13-6/h2-5H,12H2,1H3,(H,13,14)
InChIKey:
XMEPPZVJIFYELE-UHFFFAOYSA-N

Cite this record

CBID:816064 http://www.chembase.cn/molecule-816064.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
8-chloro-4-hydrazinyl-2-methylquinoline
IUPAC Traditional name
8-chloro-4-hydrazinyl-2-methylquinoline
Synonyms
8-CHLORO-4-HYDRAZINO-2-METHYL-QUINOLINE
CAS Number
203626-36-2

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
A&J Pharmtech AJA-O39692 external link Add to cart
Data Source Data ID Price
A&J Pharmtech
AJA-O39692 external link Add to cart Please log in.
Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.8002162  LogD (pH = 7.4) 2.25039 
Log P 2.257958  Molar Refractivity 59.0823 cm3
Polarizability 23.15305 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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INTERNET

INTERNET

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