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Home > Other Heterocycles > 2059939-72-7
2059939-72-7 | 2-methyl-7-oxaspiro[5.6]dodec-9-ene
CAS No: 2059939-72-7 Catalog No: AG01BZNI MDL No:MFCD30488617
Product Description
Catalog Number:
AG01BZNI
Chemical Name:
2-methyl-7-oxaspiro[5.6]dodec-9-ene
CAS Number:
2059939-72-7
Molecular Formula:
C12H20O
Molecular Weight:
180.2866
MDL Number:
MFCD30488617
IUPAC Name:
4-methyl-7-oxaspiro[5.6]dodec-9-ene
InChI:
InChI=1S/C12H20O/c1-11-6-5-8-12(10-11)7-3-2-4-9-13-12/h2,4,11H,3,5-10H2,1H3
InChI Key:
HUEPQXDTFDOYOU-UHFFFAOYSA-N
SMILES:
CC1CCCC2(C1)CCC=CCO2
Properties
Complexity:
197
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:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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