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Home > Other Heterocycles > 29587-92-6
29587-92-6 | 11-Oxabicyclo[8.1.0]undecane, (1R,10S)-rel-
CAS No: 29587-92-6 Catalog No: AG002YTT MDL No:
Product Description
Catalog Number:
AG002YTT
Chemical Name:
11-Oxabicyclo[8.1.0]undecane, (1R,10S)-rel-
CAS Number:
29587-92-6
Molecular Formula:
C10H18O
Molecular Weight:
154.2493
IUPAC Name:
(1S,10R)-11-oxabicyclo[8.1.0]undecane
InChI:
InChI=1S/C10H18O/c1-2-4-6-8-10-9(11-10)7-5-3-1/h9-10H,1-8H2/t9-,10+
InChI Key:
AFCZSFUPWLSMSZ-AOOOYVTPSA-N
SMILES:
C1CCCC[C@H]2[C@@H](CCC1)O2
EC Number:
249-703-6
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
154.136g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.253g/mol
Monoisotopic Mass:
154.136g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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