4,4'-Dibromoazoxybenzene

CAT: 0926-FD66291-01Size: 250 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0926-FD66291-01Size:250 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

1215-42-5

MDL Number

MFCD03940272

Smiles

C1=CC (=CC=C1N=[N+] (C2=CC=C (C=C2) Br) [O-]) Br

Molecular Formula

C12H8Br2N2O

Molecular Weight

356.01 g/mol

Controlled

Chemical Information

4,4'-Dibromoazoxybenzene

CAS Number	1215-42-5
PubChem CID	235166
IUPAC Name	(4-bromophenyl)-(4-bromophenyl)imino-oxidoazanium
Molecular Formula	C12H8Br2N2O
Molecular Weight	356.01
XLogP	4.5
Topological Polar Surface Area	41.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	17
Formal Charge	0
Complexity	270

SMILES

C1=CC(=CC=C1N=[N+](C2=CC=C(C=C2)Br)[O-])Br

InChI

InChI=1S/C12H8Br2N2O/c13-9-1-5-11(6-2-9)15-16(17)12-7-3-10(14)4-8-12/h1-8H

InChIKey

IPXUSIUMPSGLFK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1215-42-5

CID: 235166

Formula: C12H8Br2N2O

MW: 356.01

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	356.01
XLogP3	4.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	355.89829
Monoisotopic Mass	353.90034
Topological Polar Surface Area	41.1 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	270
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
JXB85075-01	4,4,4-Trifluorobutanethioamide
AAA46134	4,4,4-Trifluorobutanamide
FT77427	4,4,4-Trifluorovaline
AAA40687	4,4,4-Trifluorobutanal
FE60063-01	Ethyl 4,4,4-Trichloroacetoacetate
HCA98858-01	4- (4'-Bromophenyl) -4-hydroxypiperidine
FCA23456-01	4- (4-Methoxyphenyl) -4-oxobutanenitrile
FT47010-01	4,4',4''-Trimethoxytrityl chloride
IC20325-01	4- (4-Chlorophenyl) -4-hydroxypiperidine
BAA53282-01	4- (4-Methylbenzenesulfonate) -4-isoquinolinol

Catalog	Name
PC6412	4,4,4-Trifluorobutyl 4,4,4-trifluorobutanoate
PC5215	4,4,4,4',4',4'-Hexafluorovaline hydrochloride
OR1011275-01	4,4',4'',4'''-Methanetetrayltetraphenol
OR1011273-01	4,4',4'',4'''-Methanetetrayltetrabenzaldehyde
OR1011238-01	4,4,4,4-Silanetetrayltetrabenzaldehyde
PC450233-01	4,4,4,4',4',4'-Hexafluorovaline, ethyl ester
PC4810-01	4,4,4,4',4',4'-Hexafluoro-DL-valine
HY-W099255-01	Ethyl 4,4,4,4',4',4'-hexafluoro-DL-valinate
OR1011274-01	4,4',4'',4'''-Methanetetrayltetrabenzoic Acid
IN11625	(4,4′,4′′,4′′′-Tetraaminophthalocyaninato) cobalt