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4-Methylazobenzene

HCID 13705
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
6720-39-4
Standard SMILES
Cc1ccc(N=Nc2ccccc2)cc1
InChIKey
GIJSVMOPNUOZBC-UHFFFAOYSA-N
Molecular formula
C13H12N2
Average molar mass
196.25 g/mol
Monoisotopic mass
196.10004839

Names & identifiers

Preferred name
4-Methylazobenzene
IUPAC
(4-methylphenyl)-phenyldiazene
English name
4-methylazobenzene
Molecular formula
C13H12N2
Molecular weight
196.25

Names & synonyms

4-Methylazobenzene1-(4-Methylphenyl)-2-phenyldiazeneEINECS 213-444-7DTXSID90870815NSC 31005RefChem:525521DTXCID80818504213-444-7949-87-1p-MethylazobenzeneAzobenzene, 4-methyl-Diazene, (4-methylphenyl)phenyl-
Show more names
4-MethylazobenzolDiazene, 1-(4-methylphenyl)-2-phenyl-
Diazene, (4-methylphenyl)phenyl-, (E)-6720-39-41-Phenyl-2-(p-tolyl)diazeneAzobenzene, 4-methyl-, (E)-NSC31005SCHEMBL40568SCHEMBL40569CBDivE_003176

Database identifiers

CAS
6720-39-4、949-87-1
PubChem CID
13705
DTXSID
DTXSID90870815
EC Number
213-444-7
Nikkaji
J102.183D、J142.090I、J142.091G

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
24.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
15
Formal charge
0
Complexity
199

Experimental & physicochemical properties

SpringerMaterials PropertiesDiamagnetic susceptibility

Physicochemical properties

Melting point
71.5 °C · 71.5°C
Boiling point
323.14 °C · 323.14°C (rough estimate)
Density
1.1265 · 1.1265 (rough estimate)
refractive index
1.5014 · 1.5014 (estimate)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H413
Precautionary statements
264 · P264-P270-P301+P312-P330-P501

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P273, P301+P317, P330, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H413
Precautionary statements
P264-P270-P301+P312-P330-P501

Chemistry & industry

Suppliers1 total

吉林中科研伸科技有限公司18143011203 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes