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162217149 molecular structure
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(4-chlorophenyl)hydrazine

ChemBase ID: 122796
Molecular Formular: C6H7ClN2
Molecular Mass: 142.58618
Monoisotopic Mass: 142.02977591
SMILES and InChIs

SMILES:
N(c1ccc(Cl)cc1)N
Canonical SMILES:
NNc1ccc(cc1)Cl
InChI:
InChI=1S/C6H7ClN2/c7-5-1-3-6(9-8)4-2-5/h1-4,9H,8H2
InChIKey:
XXNOGQJZAOXWAQ-UHFFFAOYSA-N

Cite this record

CBID:122796 http://www.chembase.cn/molecule-122796.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(4-chlorophenyl)hydrazine
IUPAC Traditional name
4-chlorophenylhydrazine
Synonyms
(4-chlorophenyl)hydrazine
PubChem SID
162217149
PubChem CID
70624

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
InterBioScreen
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Data Source Data ID
PubChem 70624 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.7683083  LogD (pH = 7.4) 1.9657333 
Log P 1.9689331  Molar Refractivity 40.5695 cm3
Polarizability 14.744404 Å3 Polar Surface Area 38.05 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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