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75618-39-2 | 5-PYRIDIN-4-YLCYCLOHEXANE-1,3-DIONE
CAS No: 75618-39-2 Catalog No: AG00G9QY MDL No:MFCD11840300
Product Description
Catalog Number:
AG00G9QY
Chemical Name:
5-PYRIDIN-4-YLCYCLOHEXANE-1,3-DIONE
CAS Number:
75618-39-2
MDL Number:
MFCD11840300
IUPAC Name:
5-pyridin-4-ylcyclohexane-1,3-dione
InChI:
InChI=1S/C11H11NO2/c13-10-5-9(6-11(14)7-10)8-1-3-12-4-2-8/h1-4,9H,5-7H2
InChI Key:
PLOQUILDFXDGMN-UHFFFAOYSA-N
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.079g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.214g/mol
Monoisotopic Mass:
189.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
47A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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