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85429-39-6 | Lithium, [1,4,5,6-tetrahydro-2-(4-methoxyphenyl)-1-methyl-3-pyridinyl]-
CAS No: 85429-39-6 Catalog No: AG004JY3 MDL No:
Product Description
Catalog Number:
AG004JY3
Chemical Name:
Lithium, [1,4,5,6-tetrahydro-2-(4-methoxyphenyl)-1-methyl-3-pyridinyl]-
CAS Number:
85429-39-6
Molecular Formula:
C13H16LiNO
Molecular Weight:
209.2132
IUPAC Name:
lithium;6-(4-methoxyphenyl)-1-methyl-2,3,4,5-tetrahydropyridin-5-ide
InChI:
InChI=1S/C13H16NO.Li/c1-14-10-4-3-5-13(14)11-6-8-12(15-2)9-7-11;/h6-9H,3-4,10H2,1-2H3;/q-1;+1
InChI Key:
ZRTMYXMITXFXDF-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C1=C([Li])CCCN1C
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.139g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.217g/mol
Monoisotopic Mass:
209.139g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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