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(2,2-Dibromocyclopropyl) methanol

CAT: 0926-XAA08499-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0926-XAA08499-01Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
22084-99-7
MDL Number
MFCD32668498
Smiles
C1C (C1 (Br) Br) CO
Molecular Formula
C4H6Br2O
Molecular Weight
229.9 g/mol
Controlled
No

Chemical Information

2,2-Dibromocyclopropanemethanol
CAS Number22084-99-7
PubChem CID10889708
IUPAC Name(2,2-dibromocyclopropyl)methanol
Molecular FormulaC4H6Br2O
Molecular Weight229.90
XLogP1.4
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count7
Formal Charge0
Complexity81
SMILES
C1C(C1(Br)Br)CO
InChI
InChI=1S/C4H6Br2O/c5-4(6)1-3(4)2-7/h3,7H,1-2H2
InChIKey
WGGWTNZMORMBKX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,2-Dibromocyclopropanemethanol
CAS: 22084-99-7
CID: 10889708
Formula: C4H6Br2O
MW: 229.90
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight229.90
XLogP31.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass229.87649
Monoisotopic Mass227.87854
Topological Polar Surface Area20.2 Ų
Heavy Atom Count7
Formal Charge0
Complexity81.8
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

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