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1019331-35-1 | 1-(4-Chlorobenzyl)piperidin-3-aminesulfate
CAS No: 1019331-35-1 Catalog No: AG01FO7D MDL No:
Product Description
Catalog Number:
AG01FO7D
Chemical Name:
1-(4-Chlorobenzyl)piperidin-3-aminesulfate
CAS Number:
1019331-35-1
IUPAC Name:
1-[(4-chlorophenyl)methyl]piperidin-3-amine;sulfuric acid
InChI:
InChI=1S/C12H17ClN2.H2O4S/c13-11-5-3-10(4-6-11)8-15-7-1-2-12(14)9-15;1-5(2,3)4/h3-6,12H,1-2,7-9,14H2;(H2,1,2,3,4)
InChI Key:
PCPSLVGNTOTXEH-UHFFFAOYSA-N
Properties
Complexity:
271
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.075g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
322.804g/mol
Monoisotopic Mass:
322.075g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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