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1394042-86-4 | 2-(propan-2-yl)-1,2,3,4-tetrahydroquinoline hydrochloride
CAS No: 1394042-86-4 Catalog No: AG01A0J5 MDL No:MFCD22378747
Product Description
Catalog Number:
AG01A0J5
Chemical Name:
2-(propan-2-yl)-1,2,3,4-tetrahydroquinoline hydrochloride
CAS Number:
1394042-86-4
Molecular Formula:
C12H18ClN
Molecular Weight:
211.7310
MDL Number:
MFCD22378747
IUPAC Name:
2-propan-2-yl-1,2,3,4-tetrahydroquinoline;hydrochloride
InChI:
InChI=1S/C12H17N.ClH/c1-9(2)11-8-7-10-5-3-4-6-12(10)13-11;/h3-6,9,11,13H,7-8H2,1-2H3;1H
InChI Key:
KZLWGKCJODLEKB-UHFFFAOYSA-N
SMILES:
CC(C1CCc2c(N1)cccc2)C.Cl
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.113g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
211.733g/mol
Monoisotopic Mass:
211.113g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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