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Home > Other Heterocycles > 2060038-53-9
2060038-53-9 | 3-tert-butyl-7-oxaspiro[5.6]dodec-9-ene
CAS No: 2060038-53-9 Catalog No: AG01BZNG MDL No:MFCD30488615
Product Description
Catalog Number:
AG01BZNG
Chemical Name:
3-tert-butyl-7-oxaspiro[5.6]dodec-9-ene
CAS Number:
2060038-53-9
Molecular Formula:
C15H26O
Molecular Weight:
222.3663
MDL Number:
MFCD30488615
IUPAC Name:
3-tert-butyl-7-oxaspiro[5.6]dodec-9-ene
InChI:
InChI=1S/C15H26O/c1-14(2,3)13-7-10-15(11-8-13)9-5-4-6-12-16-15/h4,6,13H,5,7-12H2,1-3H3
InChI Key:
HOKOEAVZXYDQPN-UHFFFAOYSA-N
SMILES:
CC(C1CCC2(CC1)CCC=CCO2)(C)C
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.198g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.372g/mol
Monoisotopic Mass:
222.198g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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