2-bromo-1-ethoxy-4-methoxybenzene

CAT: 0127-OR1096714-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1096714-01Size:250 mg

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CAS Number

1309933-33-2

MDL Number

MFCD18917878

Purity

97%

Smiles

C1c (cc (c (c1) OCC) Br) OC

Chemical Information

2-Bromo-1-ethoxy-4-methoxybenzene

CAS Number	1309933-33-2
PubChem CID	20701296
IUPAC Name	2-bromo-1-ethoxy-4-methoxybenzene
Molecular Formula	C9H11BrO2
Molecular Weight	231.09
XLogP	2.9
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	130

SMILES

CCOC1=C(C=C(C=C1)OC)Br

InChI

InChI=1S/C9H11BrO2/c1-3-12-9-5-4-7(11-2)6-8(9)10/h4-6H,3H2,1-2H3

InChIKey

YGAKEHPEXSNMRE-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1309933-33-2

CID: 20701296

Formula: C9H11BrO2

MW: 231.09

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	231.09
XLogP3	2.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	229.99424
Monoisotopic Mass	229.99424
Topological Polar Surface Area	18.5 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	130
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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OR1098950-01	1-bromo-2-ethoxy-4-methoxybenzene
OR1095437-01	2-Bromo-4-ethoxy-1-methoxybenzene
OR1099034	1-Bromo-2-ethoxy-3-methoxybenzene
OR1096384-01	1-bromo-3-ethoxy-2-methoxybenzene
OR1048498-01	2-Bromo-1-ethoxy-3-methoxybenzene
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OR1088480-01	1-Bromo-2-chloro-4-ethoxy-5-methoxybenzene

Catalog	Name
409345-01	1-Bromo-4-ethoxy-2-methoxybenzene
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LAC67930-01	1-Bromo-4- (difluoromethoxy) -2-methoxybenzene
LAC55232-01	1-Bromo-2- (difluoromethoxy) -4-methoxybenzene
NEA15038-01	1-Bromo-4-ethenyl-2-methoxybenzene
HAA01752-01	4-Bromo-2- (chloromethyl) -1-methoxybenzene
AAA70194-01	2-Bromo-4- (chloromethyl) -1-methoxybenzene
EAC03435	4-Bromo-1- (difluoromethyl) -2-methoxybenzene