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Home > Other Heterocycles > 489412-77-3
489412-77-3 | Bicyclo[3.2.1]octan-6-one, 4,7-dimethyl-
CAS No: 489412-77-3 Catalog No: AG006VYU MDL No:
Product Description
Catalog Number:
AG006VYU
Chemical Name:
Bicyclo[3.2.1]octan-6-one, 4,7-dimethyl-
CAS Number:
489412-77-3
Molecular Formula:
C10H16O
Molecular Weight:
152.2334
IUPAC Name:
4,7-dimethylbicyclo[3.2.1]octan-6-one
InChI:
InChI=1S/C10H16O/c1-6-3-4-8-5-9(6)10(11)7(8)2/h6-9H,3-5H2,1-2H3
InChI Key:
ZDFFSYHGDNXURJ-UHFFFAOYSA-N
SMILES:
CC1C2CCC(C(C1=O)C2)C
Properties
Complexity:
185
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:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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