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161886-22-2 molecular structure
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(3,4-difluorophenyl)hydrazine

ChemBase ID: 93329
Molecular Formular: C6H6F2N2
Molecular Mass: 144.1220464
Monoisotopic Mass: 144.04990464
SMILES and InChIs

SMILES:
N(c1cc(c(cc1)F)F)N
Canonical SMILES:
NNc1ccc(c(c1)F)F
InChI:
InChI=1S/C6H6F2N2/c7-5-2-1-4(10-9)3-6(5)8/h1-3,10H,9H2
InChIKey:
KBSCNXDDCDSLLP-UHFFFAOYSA-N

Cite this record

CBID:93329 http://www.chembase.cn/molecule-93329.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(3,4-difluorophenyl)hydrazine
IUPAC Traditional name
(3,4-difluorophenyl)hydrazine
Synonyms
3,4-Difluorophenylhydrazine
(3,4-difluorophenyl)hydrazine
CAS Number
161886-22-2
MDL Number
MFCD03788477
PubChem SID
162080014
PubChem CID
2774209

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 2774209 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.504108  LogD (pH = 7.4) 1.6481092 
Log P 1.6502923  Molar Refractivity 36.1975 cm3
Polarizability 12.342857 Å3 Polar Surface Area 38.05 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Bioassay(PubChem)
Storage Warning
Irritant expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

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