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1017200-81-5 | 3,6,7-TRIMETHYL-1,2,3,4-TETRAHYDROQUINOLINE
CAS No: 1017200-81-5 Catalog No: AG01DX6I MDL No:MFCD09896594
Product Description
Catalog Number:
AG01DX6I
Chemical Name:
3,6,7-TRIMETHYL-1,2,3,4-TETRAHYDROQUINOLINE
CAS Number:
1017200-81-5
Molecular Formula:
C12H17N
Molecular Weight:
175.2701
MDL Number:
MFCD09896594
IUPAC Name:
3,6,7-trimethyl-1,2,3,4-tetrahydroquinoline
InChI:
InChI=1S/C12H17N/c1-8-4-11-5-9(2)10(3)6-12(11)13-7-8/h5-6,8,13H,4,7H2,1-3H3
InChI Key:
PSWZPBYOZIVARA-UHFFFAOYSA-N
SMILES:
CC1CNc2c(C1)cc(c(c2)C)C
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.136g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
175.275g/mol
Monoisotopic Mass:
175.136g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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