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Home > Other Heterocycles > 2059934-05-1
2059934-05-1 | 5'-methyl-3-oxaspiro[bicyclo[5.1.0]octane-4,1'-cyclopentane]
CAS No: 2059934-05-1 Catalog No: AG01BZOT MDL No:MFCD30488793
Product Description
Catalog Number:
AG01BZOT
Chemical Name:
5'-methyl-3-oxaspiro[bicyclo[5.1.0]octane-4,1'-cyclopentane]
CAS Number:
2059934-05-1
Molecular Formula:
C12H20O
Molecular Weight:
180.2866
MDL Number:
MFCD30488793
IUPAC Name:
2'-methylspiro[3-oxabicyclo[5.1.0]octane-4,1'-cyclopentane]
InChI:
InChI=1S/C12H20O/c1-9-3-2-5-12(9)6-4-10-7-11(10)8-13-12/h9-11H,2-8H2,1H3
InChI Key:
SANGUNBZVGIKJH-UHFFFAOYSA-N
SMILES:
CC1CCCC21CCC1C(CO2)C1
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.151g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.291g/mol
Monoisotopic Mass:
180.151g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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