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4169-27-1 | octahydroquinolin-2(1H)-one
CAS No: 4169-27-1 Catalog No: AG00CJFX MDL No:
Product Description
Catalog Number:
AG00CJFX
Chemical Name:
octahydroquinolin-2(1H)-one
CAS Number:
4169-27-1
IUPAC Name:
3,4,4a,5,6,7,8,8a-octahydro-1H-quinolin-2-one
InChI:
InChI=1S/C9H15NO/c11-9-6-5-7-3-1-2-4-8(7)10-9/h7-8H,1-6H2,(H,10,11)
InChI Key:
OBSYXAXPUGVQSN-UHFFFAOYSA-N
NSC Number:
250941
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:
1
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:
1.3
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