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4629-75-8 | OCTAHYDRO-QUINOLIN-4-ONE
CAS No: 4629-75-8 Catalog No: AG00DEL9 MDL No:
Product Description
Catalog Number:
AG00DEL9
Chemical Name:
OCTAHYDRO-QUINOLIN-4-ONE
CAS Number:
4629-75-8
IUPAC Name:
2,3,4a,5,6,7,8,8a-octahydro-1H-quinolin-4-one
InChI:
InChI=1S/C9H15NO/c11-9-5-6-10-8-4-2-1-3-7(8)9/h7-8,10H,1-6H2
InChI Key:
VZTBFFGJFFYFRT-UHFFFAOYSA-N
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.115g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
153.225g/mol
Monoisotopic Mass:
153.115g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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