2,5-Dimethoxytoluene

CAT: 0127-OR925248-01Size: 1 gDry Ice: NoHazardous: No

1 / 1

CAT#:0127-OR925248-01Size:1 g

Selected

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

Quick Request Actions

CAS Number

24599-58-4

MDL Number

MFCD00041901

Purity

98%

Smiles

COc1ccc(OC)c(C)c1

Chemical Information

2,5-Dimethoxytoluene

CAS Number	24599-58-4
PubChem CID	90552
IUPAC Name	1,4-dimethoxy-2-methylbenzene
Molecular Formula	C9H12O2
Molecular Weight	152.19
XLogP	2.7
Topological Polar Surface Area	18.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	114

SMILES

CC1=C(C=CC(=C1)OC)OC

InChI

InChI=1S/C9H12O2/c1-7-6-8(10-2)4-5-9(7)11-3/h4-6H,1-3H3

InChIKey

IQISOVKPFBLQIQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 24599-58-4

CID: 90552

Formula: C9H12O2

MW: 152.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	152.19
XLogP3	2.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	152.083729621
Monoisotopic Mass	152.083729621
Topological Polar Surface Area	18.5 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	114
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
OR936509-01	3,5-Dimethoxytoluene
BUP18688-01	3,5-Dimethoxytoluene
OR89679-01	2,3-Dimethoxytoluene
OR1010174-01	2,6-Dimethoxytoluene
OR1021159	2,4-Dimethoxytoluene
OR933361-01	3,4-Dimethoxytoluene
OR1079314	5,5'''-Dihexyl-2,2':5',2'':5'',2'''-quaterthiophene
OR1079313	5,5'''-Didecyl-2,2':5',2'':5'',2'''-quaterthiophene
OR1079310	5,5'''-Didodecyl-2,2':5',2'':5'',2'''-quaterthiophene
OR1042721-01	[2,2':5',2''-Terthiophene]-5,5''-dicarboxaldehyde