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54768-19-3 | Quinoline, 1,2,3,4-tetrahydro-6-(1-methylethyl)- (9CI)
CAS No: 54768-19-3 Catalog No: AG00DLJJ MDL No:MFCD09741192
Product Description
Catalog Number:
AG00DLJJ
Chemical Name:
Quinoline, 1,2,3,4-tetrahydro-6-(1-methylethyl)- (9CI)
CAS Number:
54768-19-3
Molecular Formula:
C12H17N
Molecular Weight:
175.2701
MDL Number:
MFCD09741192
IUPAC Name:
6-propan-2-yl-1,2,3,4-tetrahydroquinoline
InChI:
InChI=1S/C12H17N/c1-9(2)10-5-6-12-11(8-10)4-3-7-13-12/h5-6,8-9,13H,3-4,7H2,1-2H3
InChI Key:
JEABVAYJIJIXLO-UHFFFAOYSA-N
SMILES:
CC(c1ccc2c(c1)CCCN2)C
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.136g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
175.275g/mol
Monoisotopic Mass:
175.136g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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