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204636-08-8

204636-08-8 | Isoquinoline, 3,4-dihydro-5,8-dimethoxy-1,3,3-trimethyl-

CAS No: 204636-08-8 Catalog No: AG0029MS MDL No:

Product Description

Catalog Number:
AG0029MS
Chemical Name:
Isoquinoline, 3,4-dihydro-5,8-dimethoxy-1,3,3-trimethyl-
CAS Number:
204636-08-8
Molecular Formula:
C14H19NO2
Molecular Weight:
233.3062
IUPAC Name:
5,8-dimethoxy-1,3,3-trimethyl-4H-isoquinoline
InChI:
InChI=1S/C14H19NO2/c1-9-13-10(8-14(2,3)15-9)11(16-4)6-7-12(13)17-5/h6-7H,8H2,1-5H3
InChI Key:
WUJZLQIYTPPRAD-UHFFFAOYSA-N
SMILES:
COc1ccc(c2c1CC(C)(C)N=C2C)OC

Properties

Complexity:
311  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.142g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.311g/mol
Monoisotopic Mass:
233.142g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
30.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

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