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1-Bromo-2-phenoxyethane

CAT: 0024-sc-208625Size: 2.5 gDry Ice: NoHazardous: No
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CAT#:0024-sc-208625Size:2.5 g
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CAS Number
589-10-6

Chemical Information

Benzene, (2-bromoethoxy)-
CAS Number589-10-6
PubChem CID68526
IUPAC Name2-bromoethoxybenzene
Molecular FormulaC8H9BrO
Molecular Weight201.06
XLogP2.6
Topological Polar Surface Area9.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Heavy Atom Count10
Formal Charge0
Complexity79
SMILES
C1=CC=C(C=C1)OCCBr
InChI
InChI=1S/C8H9BrO/c9-6-7-10-8-4-2-1-3-5-8/h1-5H,6-7H2
InChIKey
JJFOBACUIRKUPN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benzene, (2-bromoethoxy)-
CAS: 589-10-6
CID: 68526
Formula: C8H9BrO
MW: 201.06
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight201.06
XLogP32.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Exact Mass199.98368
Monoisotopic Mass199.98368
Topological Polar Surface Area9.2 Ų
Heavy Atom Count10
Formal Charge0
Complexity79.3
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

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Alternative Products

CatalogName
TRC-B686385-2.5G1-Bromo-2-phenoxyethane
AEA38338-012-Phenoxyethane-1-sulfonamide
PC13531-Bromo-2- (2-bromo-1-chlorotrifluoroethyl) cyclohexane
BCA10030-012-Bromo-1- (2-bromo-1,1-difluoroethoxy) -1,1-difluoroethane
GDA21695-012-Bromo-1- (3-bromo-2-thienyl) -1-ethanone
TRC-B695540-250MG4-Bromo-2-(1-bromo-2,2,2-trifluoroethyl)-1-methoxybenzene
430644-014-Bromo-2- (1-bromo-2,2,2-trifluoroethyl) -1-methoxybenzene
PC1007514-011-Bromo-4- (2-bromo-1,1,2,2-tetrafluoro-ethoxy) benzene
GDC94448-012-Bromo-1- (4-bromo-2-fluorophenyl) ethane
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