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123593-99-7 | Isoquinoline, 1,2,3,4-tetrahydro-5-methyl-
CAS No: 123593-99-7 Catalog No: AG000KU7 MDL No:MFCD08544282
Product Description
Catalog Number:
AG000KU7
Chemical Name:
Isoquinoline, 1,2,3,4-tetrahydro-5-methyl-
CAS Number:
123593-99-7
Molecular Formula:
C10H13N
Molecular Weight:
147.2169
MDL Number:
MFCD08544282
IUPAC Name:
5-methyl-1,2,3,4-tetrahydroisoquinoline
InChI:
InChI=1S/C10H13N/c1-8-3-2-4-9-7-11-6-5-10(8)9/h2-4,11H,5-7H2,1H3
InChI Key:
QZGXYVCFHDTRMW-UHFFFAOYSA-N
SMILES:
Cc1cccc2c1CCNC2
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:
1
Isotope Atom Count:
0
Molecular Weight:
147.221g/mol
Monoisotopic Mass:
147.105g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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