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Pentanenitrile, 2,2'-(1,2-diazenediyl)bis[2-methyl-

HCID 206038
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
13393-65-2
Standard SMILES
CCCC(C)(C#N)N=NC(C)(C#N)CCC
InChIKey
ODKBBGGUUMCXFY-UHFFFAOYSA-N
Molecular formula
C12H20N4
Average molar mass
220.31 g/mol
Monoisotopic mass
220.16879665

Names & identifiers

Preferred name
Pentanenitrile, 2,2'-(1,2-diazenediyl)bis[2-methyl-
IUPAC
2-(2-cyanopentan-2-yldiazenyl)-2-methylpentanenitrile

Names & synonyms

Pentanenitrile, 2,2'-azobis(2-methyl-DTXSID90884598Pentanenitrile, 2,2'-(1,2-diazenediyl)bis(2-methyl-Pentanenitrile, 2,2'-azobis[2-methyl-Pentanenitrile, 2,2'-(1,2-diazenediyl)bis[2-methyl-RefChem:859937DTXCID80102403113393-65-2SCHEMBL221492SCHEMBL2214932,2'-azobis(2-cyanopentane)2,2'-azo-bis-(2-methylvaleronitrile)
Show more names
2,2'-Diazenediylbis(2-methylpentanenitrile)

Database identifiers

CAS
13393-65-2
PubChem CID
206038
DTXSID
DTXSID90884598
Nikkaji
J1.835.703H

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
72.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
16
Formal charge
0
Complexity
309

Safety & regulation

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

Hazard information

Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationPentanenitrile, 2,2'-(1,2-diazenediyl)bis[2-methyl-: INACTIVE

Related reactions

3 records
New reaction record
HRID 908072 reaction equation
HRID 908072As reactantuspto-grants-2011_09
HRID 1912242 reaction equation
HRID 1912242As reactantuspto-grants-2013_12
HRID 1912243 reaction equation
HRID 1912243As reactantuspto-grants-2013_12

Compound notes

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