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Home > Pyridines > 1427380-83-3
1427380-83-3 | 4-(3,5-dimethylphenyl)-1,2,3,6-tetrahydropyridine hydrochloride
CAS No: 1427380-83-3 Catalog No: AG01A45V MDL No:MFCD23144249
Product Description
Catalog Number:
AG01A45V
Chemical Name:
4-(3,5-dimethylphenyl)-1,2,3,6-tetrahydropyridine hydrochloride
CAS Number:
1427380-83-3
Molecular Formula:
C13H18ClN
Molecular Weight:
223.7417
MDL Number:
MFCD23144249
IUPAC Name:
4-(3,5-dimethylphenyl)-1,2,3,6-tetrahydropyridine;hydrochloride
InChI:
InChI=1S/C13H17N.ClH/c1-10-7-11(2)9-13(8-10)12-3-5-14-6-4-12;/h3,7-9,14H,4-6H2,1-2H3;1H
InChI Key:
RSGDJFWZESEIFH-UHFFFAOYSA-N
SMILES:
Cc1cc(C)cc(c1)C1=CCNCC1.Cl
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.113g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
223.744g/mol
Monoisotopic Mass:
223.113g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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