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104330-69-0 | 1-(2-Methylbenzyl)-3,4-dihydroisoquinoline
CAS No: 104330-69-0 Catalog No: AG009769 MDL No:
Product Description
Catalog Number:
AG009769
Chemical Name:
1-(2-Methylbenzyl)-3,4-dihydroisoquinoline
CAS Number:
104330-69-0
IUPAC Name:
1-[(2-methylphenyl)methyl]-3,4-dihydroisoquinoline
InChI:
InChI=1S/C17H17N/c1-13-6-2-3-8-15(13)12-17-16-9-5-4-7-14(16)10-11-18-17/h2-9H,10-12H2,1H3
InChI Key:
JLVQCRPNRBZDJV-UHFFFAOYSA-N
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.136g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.33g/mol
Monoisotopic Mass:
235.136g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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