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1519448-80-6 | 7-(benzyloxy)-1-methyl-1,2,3,4-tetrahydroisoquinoline
CAS No: 1519448-80-6 Catalog No: AG01DVIF MDL No:MFCD17061866
Product Description
Catalog Number:
AG01DVIF
Chemical Name:
7-(benzyloxy)-1-methyl-1,2,3,4-tetrahydroisoquinoline
CAS Number:
1519448-80-6
Molecular Formula:
C17H19NO
Molecular Weight:
253.3389
MDL Number:
MFCD17061866
IUPAC Name:
1-methyl-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline
InChI:
InChI=1S/C17H19NO/c1-13-17-11-16(8-7-15(17)9-10-18-13)19-12-14-5-3-2-4-6-14/h2-8,11,13,18H,9-10,12H2,1H3
InChI Key:
OGCXEUSPCWTAFN-UHFFFAOYSA-N
SMILES:
CC1NCCc2c1cc(OCc1ccccc1)cc2
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.147g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
253.345g/mol
Monoisotopic Mass:
253.147g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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