2,2'-Diazenediylbis(2-methylpropanimidamide)

HCID 1969CAS 13217-66-8

Basic information

Standard SMILES
CC(C)(N=NC(C)(C)C(=N)N)C(=N)N
InChIKey
CCTFAOUOYLVUFG-UHFFFAOYSA-N
Molecular formula
C8H18N6
Average molar mass
198.27 g/mol
Monoisotopic mass
198.15929458

Overview

2-(1-amino-1-imino-2-methylpropan-2-yl)azo-2-methylpropanimidamide is a monoazo compound.

Names & identifiers

Preferred name
2,2'-Diazenediylbis(2-methylpropanimidamide)
IUPAC
2-[(1-amino-1-imino-2-methylpropan-2-yl)diazenyl]-2-methylpropanimidamide
English name
2,2'-azobis(2-amidinopropane)
Molecular formula
C8H18N6
Molecular weight
198.27

Names & synonyms

DTXSID001335783RefChem:1058894DTXCID408098572,2'-Diazenediylbis(2-methylpropanimidamide)13217-66-82,2'-Azobis(2-amidinopropane)2-[(1-amino-1-imino-2-methylpropan-2-yl)diazenyl]-2-methylpropanimidamidePropanimidamide,2,2'-(1,2-diazenediyl)bis[2-methyl-2,2'-AZO-bis-2-AMINOPROPANEAmph cpdABAPHNSC668416
Show more names
Propanimidamide, 2,2'-(1,2-diazenediyl)bis[2-methyl-
2,2'-azobis[2-amidinopropane]dihydrochloride{2,2'-Azobis[2-amidinopropane]dihydrochloride}2,2/'-azobis(2-amidinopropane)2,2'-Azobis(2-methylpropionamidine)azo-bisisobutyroamidineRaltegravir Impurity 12SCHEMBL246818SCHEMBL246819

Database identifiers

CAS
13217-66-8
PubChem CID
1969
DTXSID
DTXSID001335783
ChEMBL
CHEMBL1619966、CHEMBL1623736
ChEBI
CHEBI:94003
Nikkaji
J39.905A

Properties

Computed structural properties

XLogP
-0.2
Topological polar surface area
124 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
14

Experimental & physicochemical properties

Collision Cross Section147.68 Ų [M+Na]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]

Chemistry & industry

Additional notes

DefinitionChEBI: 2-(1-amino-1-imino-2-methylpropan-2-yl)azo-2-methylpropanimidamide is an azo compound.

Related reactions

3 records

Linked notes

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