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2- (4-Bromophenyl) tetrahydrofuran

CAT: 0127-OR471716-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0127-OR471716-01Size:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
194725-15-0
MDL Number
MFCD19320036
Purity
95%
Smiles
Brc1ccc (cc1) C2CCCO2

Chemical Information

2-(4-Bromophenyl)oxolane
CAS Number194725-15-0
PubChem CID14653181
IUPAC Name2-(4-bromophenyl)oxolane
Molecular FormulaC10H11BrO
Molecular Weight227.10
XLogP2.8
Topological Polar Surface Area9.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count12
Formal Charge0
Complexity141
SMILES
C1CC(OC1)C2=CC=C(C=C2)Br
InChI
InChI=1S/C10H11BrO/c11-9-5-3-8(4-6-9)10-2-1-7-12-10/h3-6,10H,1-2,7H2
InChIKey
OUJWSBTVHIGHIS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(4-Bromophenyl)oxolane
CAS: 194725-15-0
CID: 14653181
Formula: C10H11BrO
MW: 227.10
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight227.10
XLogP32.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass225.99933
Monoisotopic Mass225.99933
Topological Polar Surface Area9.2 Ų
Heavy Atom Count12
Formal Charge0
Complexity141
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes