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Cyclobutyl (cyclopropyl) methanol

CAT: 0926-UIA71734-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0926-UIA71734-01Size:50 mg
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CAS Number
219717-34-7
MDL Number
MFCD21117621
Smiles
C1CC (C1) C (C2CC2) O
Molecular Formula
C8H14O
Molecular Weight
126.2 g/mol
Controlled
No

Chemical Information

Cyclobutyl(cyclopropyl)methanol
CAS Number219717-34-7
PubChem CID64986421
IUPAC Namecyclobutyl(cyclopropyl)methanol
Molecular FormulaC8H14O
Molecular Weight126.20
XLogP1.6
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count9
Formal Charge0
Complexity103
SMILES
C1CC(C1)C(C2CC2)O
InChI
InChI=1S/C8H14O/c9-8(7-4-5-7)6-2-1-3-6/h6-9H,1-5H2
InChIKey
RTQYMILESADSGN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Cyclobutyl(cyclopropyl)methanol
CAS: 219717-34-7
CID: 64986421
Formula: C8H14O
MW: 126.20
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight126.20
XLogP31.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass126.104465066
Monoisotopic Mass126.104465066
Topological Polar Surface Area20.2 Ų
Heavy Atom Count9
Formal Charge0
Complexity103
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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