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41381-73-1 | 7-METHOXY-2,2,4-TRIMETHYL-1,2,3,4-TETRAHYDROQUINOLINE
CAS No: 41381-73-1 Catalog No: AG01DWF5 MDL No:MFCD22056846
Product Description
Catalog Number:
AG01DWF5
Chemical Name:
7-METHOXY-2,2,4-TRIMETHYL-1,2,3,4-TETRAHYDROQUINOLINE
CAS Number:
41381-73-1
Molecular Formula:
C13H19NO
Molecular Weight:
205.2961
MDL Number:
MFCD22056846
IUPAC Name:
7-methoxy-2,2,4-trimethyl-3,4-dihydro-1H-quinoline
InChI:
InChI=1S/C13H19NO/c1-9-8-13(2,3)14-12-7-10(15-4)5-6-11(9)12/h5-7,9,14H,8H2,1-4H3
InChI Key:
JOQIPMNHEXDDIH-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)NC(CC2C)(C)C
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.147g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
205.301g/mol
Monoisotopic Mass:
205.147g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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