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1612-65-3 | Isoquinoline, 1,2,3,4-tetrahydro-2-methyl-
CAS No: 1612-65-3 Catalog No: AG001S9A MDL No:MFCD00040623
Product Description
Catalog Number:
AG001S9A
Chemical Name:
Isoquinoline, 1,2,3,4-tetrahydro-2-methyl-
CAS Number:
1612-65-3
Molecular Formula:
C10H13N
Molecular Weight:
147.2169
MDL Number:
MFCD00040623
IUPAC Name:
2-methyl-3,4-dihydro-1H-isoquinoline
InChI:
InChI=1S/C10H13N/c1-11-7-6-9-4-2-3-5-10(9)8-11/h2-5H,6-8H2,1H3
InChI Key:
KYXSVGVQGFPNRQ-UHFFFAOYSA-N
SMILES:
CN1CCc2c(C1)cccc2
Properties
Complexity:
133
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.105g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
147.221g/mol
Monoisotopic Mass:
147.105g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Literature
| Title | Journal |
|---|---|
| Both stereoselective (R)- and (S)-1-Methyl-1,2,3,4-tetrahydroisoquinoline enantiomers protect striatal terminals against rotenone-induced suppression of dopamine release. | Neurotoxicity research 20110801 |
| Metabolic aromatization of N-alkyl-1,2,3,4-tetrahydroquinoline substructures to quinolinium by human liver microsomes and horseradish peroxidase. | Drug metabolism and disposition: the biological fate of chemicals 20061201 |
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