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Home > Pyridines > 387827-21-6
387827-21-6 | Acetamide, N-[3-(1,2,3,6-tetrahydro-4-pyridinyl)phenyl]-,monohydrochloride
CAS No: 387827-21-6 Catalog No: AG019F2L MDL No:MFCD29075573
Product Description
Catalog Number:
AG019F2L
Chemical Name:
Acetamide, N-[3-(1,2,3,6-tetrahydro-4-pyridinyl)phenyl]-,monohydrochloride
CAS Number:
387827-21-6
Molecular Formula:
C13H17ClN2O
Molecular Weight:
252.7399
MDL Number:
MFCD29075573
IUPAC Name:
N-[3-(1,2,3,6-tetrahydropyridin-4-yl)phenyl]acetamide;hydrochloride
InChI:
InChI=1S/C13H16N2O.ClH/c1-10(16)15-13-4-2-3-12(9-13)11-5-7-14-8-6-11;/h2-5,9,14H,6-8H2,1H3,(H,15,16);1H
InChI Key:
BYPBRKKVMCDMCR-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1cccc(c1)C1=CCNCC1.Cl
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.103g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
252.742g/mol
Monoisotopic Mass:
252.103g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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