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1249695-87-1 | 6,8-dimethyl-1,2,3,4-tetrahydroisoquinoline
CAS No: 1249695-87-1 Catalog No: AG01AFP6 MDL No:MFCD16743921
Product Description
Catalog Number:
AG01AFP6
Chemical Name:
6,8-dimethyl-1,2,3,4-tetrahydroisoquinoline
CAS Number:
1249695-87-1
Molecular Formula:
C11H15N
Molecular Weight:
161.2435
MDL Number:
MFCD16743921
IUPAC Name:
6,8-dimethyl-1,2,3,4-tetrahydroisoquinoline
InChI:
InChI=1S/C11H15N/c1-8-5-9(2)11-7-12-4-3-10(11)6-8/h5-6,12H,3-4,7H2,1-2H3
InChI Key:
ZFPWKVIUPYDEFE-UHFFFAOYSA-N
SMILES:
Cc1cc2CCNCc2c(c1)C
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.12g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
161.248g/mol
Monoisotopic Mass:
161.12g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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