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65818-00-0 | Isoquinoline, 5,6,7,8-tetrahydro-1,3-dimethyl-
CAS No: 65818-00-0 Catalog No: AG006OFH MDL No:
Product Description
Catalog Number:
AG006OFH
Chemical Name:
Isoquinoline, 5,6,7,8-tetrahydro-1,3-dimethyl-
CAS Number:
65818-00-0
Molecular Formula:
C11H15N
Molecular Weight:
161.2435
IUPAC Name:
1,3-dimethyl-5,6,7,8-tetrahydroisoquinoline
InChI:
InChI=1S/C11H15N/c1-8-7-10-5-3-4-6-11(10)9(2)12-8/h7H,3-6H2,1-2H3
InChI Key:
RXDXHINXYVKPCA-UHFFFAOYSA-N
SMILES:
Cc1cc2CCCCc2c(n1)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:
0
Isotope Atom Count:
0
Molecular Weight:
161.248g/mol
Monoisotopic Mass:
161.12g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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