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249624-84-8

249624-84-8 | Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-3-methyl-

CAS No: 249624-84-8 Catalog No: AG002PZT MDL No:

Product Description

Catalog Number:
AG002PZT
Chemical Name:
Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-3-methyl-
CAS Number:
249624-84-8
Molecular Formula:
C12H17NO2
Molecular Weight:
207.2689
IUPAC Name:
6,7-dimethoxy-3-methyl-1,2,3,4-tetrahydroisoquinoline
InChI:
InChI=1S/C12H17NO2/c1-8-4-9-5-11(14-2)12(15-3)6-10(9)7-13-8/h5-6,8,13H,4,7H2,1-3H3
InChI Key:
SRXUBSWMMKWIBE-UHFFFAOYSA-N
SMILES:
COc1cc2CC(C)NCc2cc1OC

Properties

Complexity:
210  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.126g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
207.273g/mol
Monoisotopic Mass:
207.126g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
30.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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