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Home > Other Heterocycles > 67963-21-7
67963-21-7 | Bicyclo[4.3.1]decan-8-one
CAS No: 67963-21-7 Catalog No: AG0061NY MDL No:
Product Description
Catalog Number:
AG0061NY
Chemical Name:
Bicyclo[4.3.1]decan-8-one
CAS Number:
67963-21-7
Molecular Formula:
C10H16O
Molecular Weight:
152.2334
IUPAC Name:
bicyclo[4.3.1]decan-8-one
InChI:
InChI=1S/C10H16O/c11-10-6-8-3-1-2-4-9(5-8)7-10/h8-9H,1-7H2
InChI Key:
QEFLRRDCPNUYBA-UHFFFAOYSA-N
SMILES:
O=C1CC2CCCCC(C1)C2
Properties
Complexity:
146
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.12g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.237g/mol
Monoisotopic Mass:
152.12g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Literature
| Title | Journal |
|---|---|
| Constructing conformationally constrained macrobicyclic musks. | Chemistry (Weinheim an der Bergstrasse, Germany) 20010803 |
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