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3382-18-1 | 6,7-Dimethoxy-3,4-dihydroisoquinoline
CAS No: 3382-18-1 Catalog No: AG007INS MDL No:MFCD00266748
Product Description
Catalog Number:
AG007INS
Chemical Name:
6,7-Dimethoxy-3,4-dihydroisoquinoline
CAS Number:
3382-18-1
Molecular Formula:
C11H13NO2
Molecular Weight:
191.2264
MDL Number:
MFCD00266748
IUPAC Name:
6,7-dimethoxy-3,4-dihydroisoquinoline
InChI:
InChI=1S/C11H13NO2/c1-13-10-5-8-3-4-12-7-9(8)6-11(10)14-2/h5-7H,3-4H2,1-2H3
InChI Key:
NSLJVQUDZCZJLK-UHFFFAOYSA-N
SMILES:
COc1cc2C=NCCc2cc1OC
EC Number:
222-185-9
NSC Number:
627588
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.095g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.23g/mol
Monoisotopic Mass:
191.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Literature
| Title | Journal |
|---|---|
| Diastereomeric Reissert compounds of isoquinoline and 6,7-dimethoxy-3,4-dihydroisoquinoline in stereoselective synthesis. | The Journal of organic chemistry 20070720 |
| Formal total synthesis of (-)-emetine using catalytic asymmetric allylation of cyclic imines as a key step. | Organic letters 20060330 |
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