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28971-03-1 | 4-methyl-5,6,7,8-tetrahydroquinoline
CAS No: 28971-03-1 Catalog No: AG01DCYT MDL No:
Product Description
Catalog Number:
AG01DCYT
Chemical Name:
4-methyl-5,6,7,8-tetrahydroquinoline
CAS Number:
28971-03-1
Molecular Formula:
C10H13N
Molecular Weight:
147.2169
IUPAC Name:
4-methyl-5,6,7,8-tetrahydroquinoline
InChI:
InChI=1S/C10H13N/c1-8-6-7-11-10-5-3-2-4-9(8)10/h6-7H,2-5H2,1H3
InChI Key:
LGYCOYCCCKHXGC-UHFFFAOYSA-N
SMILES:
Cc1ccnc2c1CCCC2
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:
0
Isotope Atom Count:
0
Molecular Weight:
147.221g/mol
Monoisotopic Mass:
147.105g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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