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614-31-3 molecular structure
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1-benzyl-1-phenylhydrazine

ChemBase ID: 35174
Molecular Formular: C13H14N2
Molecular Mass: 198.26366
Monoisotopic Mass: 198.11569846
SMILES and InChIs

SMILES:
N(Cc1ccccc1)(c1ccccc1)N
Canonical SMILES:
NN(c1ccccc1)Cc1ccccc1
InChI:
InChI=1S/C13H14N2/c14-15(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10H,11,14H2
InChIKey:
SQMOOVFBFVTTGF-UHFFFAOYSA-N

Cite this record

CBID:35174 http://www.chembase.cn/molecule-35174.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
1-benzyl-1-phenylhydrazine
IUPAC Traditional name
1-benzyl-1-phenylhydrazine
Synonyms
1-Benzyl-1-phenylhydrazine
CAS Number
614-31-3
MDL Number
MFCD00059186
PubChem SID
160998481
PubChem CID
69192

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 69192 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 2.6185632  LogD (pH = 7.4) 3.123894 
Log P 3.1362777  Molar Refractivity 74.1826 cm3
Polarizability 24.38848 Å3 Polar Surface Area 29.26 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Bioassay(PubChem)
Storage Warning
IRRITANT expand Show data source
MSDS Link
Download expand Show data source
TSCA Listed
false expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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