Products for Research Use Only
RegisterLogin

1-Methoxy-3-methylbenzene

CAT: 0013-GTR19224579Size: 10 gDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19224579Size:10 g
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
1-Methoxy-3-methylbenzene is a QSAR-identified acetylcholinesterase inhibitor. It serves as a research tool in neurochemical studies for in vitro enzyme assays and is utilized in the synthesis of compounds for pharmacological investigation.
CAS Number
100-84-5
Product Name Alternative
1 Methoxy 3 methylbenzene, 1Methoxy3methylbenzene, 1-Methoxy-3-methylbenzene, 3-Methoxytoluene
Field of Research
Infectious Disease & Virology, Neuroscience
Purity
99.66% (May vary between batches)
Solubility
DMSO:4 mg/mL (32.74 mM)
Smiles
O (C1=CC=CC (=C1) C) C
Molecular Formula
C8H10O
Molecular Weight
122.16
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

3-Methoxytoluene

1-Methoxy-3-methylbenzene is a member of methoxybenzenes.

CAS Number100-84-5
PubChem CID7530
IUPAC Name1-methoxy-3-methylbenzene
Molecular FormulaC8H10O
Molecular Weight122.16
XLogP2.7
Topological Polar Surface Area9.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity80
SMILES
CC1=CC(=CC=C1)OC
InChI
InChI=1S/C8H10O/c1-7-4-3-5-8(6-7)9-2/h3-6H,1-2H3
InChIKey
OSIGJGFTADMDOB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Methoxytoluene
CAS: 100-84-5
CID: 7530
Formula: C8H10O
MW: 122.16
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight122.16
XLogP32.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass122.073164938
Monoisotopic Mass122.073164938
Topological Polar Surface Area9.2 Ų
Heavy Atom Count9
Formal Charge0
Complexity80.6
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
GTR19245785-011,3-Dibromo-5-methylbenzene
GTR19254829-012-Methylbenzene-1,3-diol
GTR19271851-013-[2- (2-hydroxy-4-methoxy-6-methylphenoxy) -4-methoxy-6-methylphenoxy]-5-methylbenzene-1,2-diol
GTR192550161-Ethyl-4-methylbenzene
GTR19160907-012-Methylbenzene-1-sulfonamide
GTR19176927-012-Methylbenzene-1-sulfonamide
GTR19254654-011-Ethyl-2-methylbenzene
GTR192336141-Methoxy-2,3-methylenedioxyxanthone
GTR19254803-01N1-Methylbenzene-1,4-diamine
GTR19254619-011-Methoxy-3,5-dimethylbenzene

Alternative Products

CatalogName
T212781-Methoxy-3-methylbenzene
TRC-F597500-100MG2-Fluoro-1-methoxy-3-methylbenzene
OR1081831-011-iodo-3-methoxy-5-methylbenzene
OR1049630-011- (Chloromethyl) -3-methoxy-2-methylbenzene
GEA11642-011- (Bromomethyl) -3-methoxy-5-methylbenzene
OR10948672-Chloro-1-methoxy-3-methylbenzene
PC100293-011-Fluoro-3-Methoxy-2-methylbenzene
OR9569451-Chloro-2-methoxy-3-methylbenzene
OR9569911-Chloro-3-methoxy-5-methylbenzene
OR10888501-iodo-2-methoxy-3-methylbenzene

Popular Products