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1159768-57-6 | 6-METHOXY-4,4-DIMETHYL-1,2,3,4-TETRAHYDROQUINOLINE
CAS No: 1159768-57-6 Catalog No: AG01C9KB MDL No:MFCD20688166
Product Description
Catalog Number:
AG01C9KB
Chemical Name:
6-METHOXY-4,4-DIMETHYL-1,2,3,4-TETRAHYDROQUINOLINE
CAS Number:
1159768-57-6
Molecular Formula:
C12H17NO
Molecular Weight:
191.2695
MDL Number:
MFCD20688166
IUPAC Name:
6-methoxy-4,4-dimethyl-2,3-dihydro-1H-quinoline
InChI:
InChI=1S/C12H17NO/c1-12(2)6-7-13-11-5-4-9(14-3)8-10(11)12/h4-5,8,13H,6-7H2,1-3H3
InChI Key:
BYTLWWRUMSXZNL-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)C(C)(C)CCN2
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.131g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.274g/mol
Monoisotopic Mass:
191.131g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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