1-Ethoxy-2-methoxybenzene

CAT: 0127-OR1009459-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-OR1009459-01Size:1 g

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CAS Number

17600-72-5

MDL Number

MFCD00870985

Purity

99%

Smiles

CCOc1ccccc1OC

Chemical Information

1-Ethoxy-2-methoxybenzene

CAS Number	17600-72-5
PubChem CID	87170
IUPAC Name	1-ethoxy-2-methoxybenzene
Molecular Formula	C9H12O2
Molecular Weight	152.19
XLogP	2.1
Topological Polar Surface Area	18.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	11
Formal Charge	0
Complexity	104

SMILES

CCOC1=CC=CC=C1OC

InChI

InChI=1S/C9H12O2/c1-3-11-9-7-5-4-6-8(9)10-2/h4-7H,3H2,1-2H3

InChIKey

OMONCKYJLBVWOQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 17600-72-5

CID: 87170

Formula: C9H12O2

MW: 152.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	152.19
XLogP3	2.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	152.083729621
Monoisotopic Mass	152.083729621
Topological Polar Surface Area	18.5 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	104
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

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PC1015804-01	2-Ethoxy-4-fluoro-1-methoxybenzene
OR1090371-01	1-ethoxy-3-iodo-2-methoxybenzene
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OR1080458-01	2-Ethoxy-4-iodo-1-methoxybenzene

Catalog	Name
409683-01	1-Ethoxy-2-methoxybenzene
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409345-01	1-Bromo-4-ethoxy-2-methoxybenzene
KCA75896-01	4-Ethoxy-3-methoxybenzene-1-carbothioamide
FA70968-01	1-Acetoxy-2-methoxybenzene
CCA28993-01	1- (Bromomethyl) -2-methoxybenzene
CAA94447	1-Isopropyl-2-methoxybenzene
RG-A260144-01	1-Fluoro-2-Methoxybenzene
280921-01	1-Iodo-2-methoxybenzene
TRC-D267140-750MG	1-(Dimethoxymethyl)-2-methoxybenzene