 Home > Encyclopedia > Bandrowski's base

Bandrowski's base

Bandrowski's base structure

CAS No:
20048-27-5
Formula:
C18H18N6
Chemical Name:
Bandrowski's base
Synonyms:
1,4-Benzenediamine,N,N′′-(2,5-diamino-2,5-cyclohexadiene-1,4-diylidene)bis-;1,4-Cyclohexadiene-1,4-diamine,3,6-bis[(p-aminophenyl)imino]-;N,N′′-(2,5-Diamino-2,5-cyclohexadiene-1,4-diylidene)bis[1,4-benzenediamine];N,N′-Bis(4-aminophenyl)-2,5-diamino-1,4-quinonediimine;Bandrowski's base;2,5-Diamino-N.N′-bis(p-aminophenyl)-1,4-benzoquinone diimine
Categories:
Organic Chemistry > Amides

Description

ChEBI: A quinone imine having amino substituents in the 2- and 5-positions and 4-aminophenyl substituents on both of the imine nitrogens. It is a trimer formed from 1,4-phenylenediamine.

Bandrowski's base is a quinone imine having amino substituents in the 2- and 5-positions and 4-aminophenyl substituents on both of the imine nitrogens. It is a trimer formed from 1,4-phenylenediamine. It has a role as a mutagen and an allergen. It derives from a 1,4-phenylenediamine.

Bandrowski's base Basic Attributes

Molecular Weight：

318.38

Exact Mass：

318.38

UNII：

63ZRE89T3Q

DSSTox ID：

DTXSID9044031

Characteristics

PSA：

129

XLogP3：

1.4

Density：

1.36±0.1 g/cm3(Predicted)

Boiling Point：

523.5ºC at 760 mmHg

Flash Point：

270.4ºC

Refractive Index：

1.714

Vapor Pressure：

4.71E-11mmHg at 25°C

Drug Information

MeSH Entry Terms：

Bandrowski's base

Computed Properties

Molecular Weight:318.4
XLogP3:1.4
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:318.15929460
Monoisotopic Mass:318.15929460
Topological Polar Surface Area:129
Heavy Atom Count:24
Complexity:520
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes