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Benzyl 2-bromoethyl ether

CAT: 0931-TYD-00638-01Size: 10 gDry Ice: NoHazardous: No
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CAT#:0931-TYD-00638-01Size:10 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1462-37-9
Bioactivity
Benzyl 2-bromoethyl ether is a biochemical reagent that can be used as a biomaterial for life science related research and as a sulfonylation reagent for organic synthesis and drug discovery.
Smiles
BrCCOCC1=CC=CC=C1
Molecular Formula
C9H11BrO
Molecular Weight
215.087
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Benzene, ((2-bromoethoxy)methyl)-
CAS Number1462-37-9
PubChem CID73833
IUPAC Name2-bromoethoxymethylbenzene
Molecular FormulaC9H11BrO
Molecular Weight215.09
XLogP2.3
Topological Polar Surface Area9.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Heavy Atom Count11
Formal Charge0
Complexity89
SMILES
C1=CC=C(C=C1)COCCBr
InChI
InChI=1S/C9H11BrO/c10-6-7-11-8-9-4-2-1-3-5-9/h1-5H,6-8H2
InChIKey
FWOHDAGPWDEWIB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benzene, ((2-bromoethoxy)methyl)-
CAS: 1462-37-9
CID: 73833
Formula: C9H11BrO
MW: 215.09
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight215.09
XLogP32.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Exact Mass213.99933
Monoisotopic Mass213.99933
Topological Polar Surface Area9.2 Ų
Heavy Atom Count11
Formal Charge0
Complexity89.6
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

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