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613-85-4 molecular structure
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(2,5-dimethylphenyl)hydrazine hydrochloride

ChemBase ID: 34752
Molecular Formular: C8H13ClN2
Molecular Mass: 172.65522
Monoisotopic Mass: 172.07672611
SMILES and InChIs

SMILES:
c1(c(ccc(c1)C)C)NN.Cl
Canonical SMILES:
NNc1cc(C)ccc1C.Cl
InChI:
InChI=1S/C8H12N2.ClH/c1-6-3-4-7(2)8(5-6)10-9;/h3-5,10H,9H2,1-2H3;1H
InChIKey:
OMOFMSZLYCEIAF-UHFFFAOYSA-N

Cite this record

CBID:34752 http://www.chembase.cn/molecule-34752.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(2,5-dimethylphenyl)hydrazine hydrochloride
IUPAC Traditional name
(2,5-dimethylphenyl)hydrazine hydrochloride
Synonyms
2,5-Dimethylphenylhydrazine hydrochloride
(2,5-Dimethylphenyl)hydrazine hydrochloride
2,5-Dimethylphenylhydrazine hydrochloride
2-(Hydrazino)-m-xylene hydrochloride
2,5-Dimethylphenylhydrazine hydrochloride 97%
2,5-DiMethylphenylhydrazinehydrochloride
2,5-二甲基苯肼 盐酸盐
CAS Number
613-85-4
56737-78-1
MDL Number
MFCD00013382
PubChem SID
160998059
24859435
PubChem CID
2734058

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 2.1377716  LogD (pH = 7.4) 2.387406 
Log P 2.3917313  Molar Refractivity 45.8471 cm3
Polarizability 16.43819 Å3 Polar Surface Area 38.05 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Melting Point
204 - 206°C expand Show data source
205 °C (dec.)(lit.) expand Show data source
205°C expand Show data source
Hydrophobicity(logP)
2.263 expand Show data source
Storage Warning
IRRITANT expand Show data source
Irritant expand Show data source
European Hazard Symbols
Irritant Irritant (Xi) expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
German water hazard class
3 expand Show data source
Risk Statements
36/37/38 expand Show data source
Safety Statements
26-36 expand Show data source
TSCA Listed
false expand Show data source
GHS Pictograms
GHS07 expand Show data source
GHS Signal Word
Warning expand Show data source
GHS Hazard statements
H315-H319-H335 expand Show data source
GHS Precautionary statements
P261-P305 + P351 + P338 expand Show data source
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves expand Show data source
Purity
95% expand Show data source
97% expand Show data source
98% expand Show data source
Salt Data
HCl expand Show data source
Linear Formula
(CH3)2C6H3NHNH2·HCl expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 324299 external link
Packaging
25 g in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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