2,2'-Dimethylazoxybenzene

CAT: 0926-FD66235Size: 3 gDry Ice: NoHazardous: No

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CAT#:0926-FD66235Size:3 g

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CAS Number

956-31-0

MDL Number

MFCD00025923

Smiles

CC1=CC=CC=C1N=[N+] (C2=CC=CC=C2C) [O-]

Molecular Formula

C14 H14N2O

Molecular Weight

226.27 g/mol

Controlled

Chemical Information

2,2'-Dimethylazoxybenzene

CAS Number	956-31-0
PubChem CID	70390
IUPAC Name	(2-methylphenyl)-(2-methylphenyl)imino-oxidoazanium
Molecular Formula	C14H14N2O
Molecular Weight	226.27
XLogP	3.9
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	277

SMILES

CC1=CC=CC=C1N=[N+](C2=CC=CC=C2C)[O-]

InChI

InChI=1S/C14H14N2O/c1-11-7-3-5-9-13(11)15-16(17)14-10-6-4-8-12(14)2/h3-10H,1-2H3

InChIKey

ROMBIGIVDIQGKC-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 956-31-0

CID: 70390

Formula: C14H14N2O

MW: 226.27

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	226.27
XLogP3	3.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	226.110613074
Monoisotopic Mass	226.110613074
Topological Polar Surface Area	41.1 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	277
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
FD145660-01	3,3'-Dimethylazoxybenzene
AAA40737	2,2,2-Trifluoro-N- (2,2,2-trifluoroethyl) acetamide
WYB72229-01	2,2,2-Trifluoroethyl N- (2,2,2-trifluoroethyl) carbamate
IXB41367-01	(2,2-Dimethylpropyl) (2,2,2-trifluoroethyl) amine
IGA88442-01	2- (2,2,2-Trifluoroethyl) benzaldehyde
AAC81537-01	2- (2,2,2-Trifluoroethoxy) propanenitrile
FT80448-01	2,2,2-Trifluoroethanesulfonamide
AAA46637	2,2,2-Triphenylacetophenone
CAA04137	2',2,2-trimethylpropiophenone
FT78199-01	2,2,2-Trifluoroethanethiol

Catalog	Name
PC1003049-01	2,2,2-Trifluoroethyl 2,2,2-trichloroacetate
H 038-005	2'- , 2''-, 2''', 2'''', 2''''', 2''''''- Hexadeoxy- 2'-, 2'', 2''', 2'''', 2''''', 2''''''- hexafluoro- cyclic hexaadenosine monophosphate (2',2'',2''',2'''',2''''',2''''''-Hexa-F-c-hexadAMP / cFA6), sodium salt
OR1009873-01	2,2,2,2-Ethylenedinitrilotetraethanol
PC32719-01	2,2,2,2'-Tetrafluoroacetophenone
290343-01	2,2,2-Trifluoroethyl 2-hydroxy-5- (2,2,2-trifluoroethoxy) benzoate
BLG-H038-001	2′,2”,2”’,2””,2””’,2”””-Hexa-F-c-hexadAMP
413025-01	2- (2- (2,2,2-Trifluoroethoxy) phenoxy) acetaldehyde
414645	2-[2- (2,2,2-Trifluoroethoxy) phenoxy]-ethanol
TRC-T790195-2.5G	2-[2-(2,2,2-Trifluoroethoxy)phenoxy]-ethanol
sc-506736	2'-Amino-2,2,2-trifluoroacetophenone