3-Ethoxy-4-methoxytoluene

CAT: 1596-AR-T05489-01Size: 10 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-T05489-01Size:10 Units

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CAS Number

52711-91-8

Molecular Formula

C10H14O2

Molecular Weight

166.22

API Name

Toluene

Chemical Information

3-Ethoxy-4-methoxytoluene

CAS Number	52711-91-8
PubChem CID	21546505
IUPAC Name	2-ethoxy-1-methoxy-4-methylbenzene
Molecular Formula	C10H14O2
Molecular Weight	166.22
XLogP	2.5
Topological Polar Surface Area	18.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	12
Formal Charge	0
Complexity	125

SMILES

CCOC1=C(C=CC(=C1)C)OC

InChI

InChI=1S/C10H14O2/c1-4-12-10-7-8(2)5-6-9(10)11-3/h5-7H,4H2,1-3H3

InChIKey

LNYCGPXAPUFTBY-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 52711-91-8

CID: 21546505

Formula: C10H14O2

MW: 166.22

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	166.22
XLogP3	2.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	166.099379685
Monoisotopic Mass	166.099379685
Topological Polar Surface Area	18.5 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	125
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
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AR-M03621-01	(3Z) -4-Ethoxy-3- (4-pyridinyl) -3-buten-2-one
AR-F01511-01	7-ethoxy-3-phenyl-4H-chromen-4-one
AR-A05322-01	Methyl 3-Ethoxy-3-Methoxypropanoate
AR-I01968-01	4- (2- (dimethylamino) ethoxy) benzonitrile
AR-M02946-01	1-Ethoxy-4- (trifluoromethyl) benzene
AR-A05321-01	1-Ethoxy-1,3,3-Trimethoxypropane
AR-C02307-01	[2-[4-[4-chlorophenylmethyl]-1-piperazinyl]-ethoxy]acetamide
AR-E10585-01	1-Ethoxy-3-Methyl-Butane
AR-C03201-01	(4- (2- (diethylamino) ethoxy) phenyl) (phenyl) methanone

Catalog	Name
FE67179-01	4-Ethoxy-3-methoxytoluene
TRC-E676413-1G	3-Ethoxy-4-methoxytoluene
FF66505-01	4-Fluoro-3-methoxytoluene
sc-283768A	3-Iodo-4-methoxytoluene
sc-281344	3-Chloro-4-methoxytoluene
TRC-P271732-50MG	4-Methoxytoluene-α,α,α-d3
430701-01	4-Bromo-2-chloro-3-methoxytoluene
FB67535-01	4-Bromo-2-methoxytoluene
M335922	3-Methoxytoluene-α,α,α-d3
sc-261924A	4-Fluoro-2-methoxytoluene