Home Other Building Blocks decahydronaphthalene-1,8-dione

decahydronaphthalene-1,8-dione

CAS No.:
83406-40-0
Catalog Number:
AG01AM8Q
Molecular Formula:
C10H14O2
Molecular Weight:
166.2170
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Product Description
Catalog Number:
AG01AM8Q
Chemical Name:
decahydronaphthalene-1,8-dione
CAS Number:
83406-40-0
Molecular Formula:
C10H14O2
Molecular Weight:
166.2170
MDL Number:
MFCD24689133
IUPAC Name:
2,3,4,4a,5,6,7,8a-octahydronaphthalene-1,8-dione
InChI:
InChI=1S/C10H14O2/c11-8-5-1-3-7-4-2-6-9(12)10(7)8/h7,10H,1-6H2
InChI Key:
MCGBZBIVNKGHNY-UHFFFAOYSA-N
SMILES:
O=C1CCCC2C1C(=O)CCC2
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.099g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.22g/mol
Monoisotopic Mass:
166.099g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties