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89445-81-8 | 8-methoxy-4-methyl-1,2,3,4-tetrahydroquinoline
CAS No: 89445-81-8 Catalog No: AG01ACD3 MDL No:MFCD09035010
Product Description
Catalog Number:
AG01ACD3
Chemical Name:
8-methoxy-4-methyl-1,2,3,4-tetrahydroquinoline
CAS Number:
89445-81-8
Molecular Formula:
C11H15NO
Molecular Weight:
177.2429
MDL Number:
MFCD09035010
IUPAC Name:
8-methoxy-4-methyl-1,2,3,4-tetrahydroquinoline
InChI:
InChI=1S/C11H15NO/c1-8-6-7-12-11-9(8)4-3-5-10(11)13-2/h3-5,8,12H,6-7H2,1-2H3
InChI Key:
VUNLJCWLGKBGBA-UHFFFAOYSA-N
SMILES:
COc1cccc2c1NCCC2C
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.115g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.247g/mol
Monoisotopic Mass:
177.115g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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