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1874-74-4 | 1-Methyloctahydro-4(1H)-quinolinone hydrochloride
CAS No: 1874-74-4 Catalog No: AG00J9OY MDL No:MFCD03410248
Product Description
Catalog Number:
AG00J9OY
Chemical Name:
1-Methyloctahydro-4(1H)-quinolinone hydrochloride
CAS Number:
1874-74-4
Molecular Formula:
C10H17NO
Molecular Weight:
167.2481
MDL Number:
MFCD03410248
IUPAC Name:
1-methyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-one
InChI:
InChI=1S/C10H17NO/c1-11-7-6-10(12)8-4-2-3-5-9(8)11/h8-9H,2-7H2,1H3
InChI Key:
RITANGGXLSWSNG-UHFFFAOYSA-N
SMILES:
O=C1CCN(C2C1CCCC2)C
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.131g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.252g/mol
Monoisotopic Mass:
167.131g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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