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Chloromethyl Cyclohexyl Ether

CAT: 0024-sc-486187Size: 25 gDry Ice: NoHazardous: No
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CAT#:0024-sc-486187Size:25 g
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CAS Number
3587-62-0

Chemical Information

(Chloromethoxy)cyclohexane
CAS Number3587-62-0
PubChem CID11309592
IUPAC Namechloromethoxycyclohexane
Molecular FormulaC7H13ClO
Molecular Weight148.63
XLogP2.6
Topological Polar Surface Area9.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count9
Formal Charge0
Complexity69
SMILES
C1CCC(CC1)OCCl
InChI
InChI=1S/C7H13ClO/c8-6-9-7-4-2-1-3-5-7/h7H,1-6H2
InChIKey
GYCLGFVWNVHUPA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (Chloromethoxy)cyclohexane
CAS: 3587-62-0
CID: 11309592
Formula: C7H13ClO
MW: 148.63
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight148.63
XLogP32.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass148.0654927
Monoisotopic Mass148.0654927
Topological Polar Surface Area9.2 Ų
Heavy Atom Count9
Formal Charge0
Complexity69.3
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