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1131614-84-0 | 3-Iodo-4-((3-Methylpiperidin-1-yl)Methyl)benzoic acid
CAS No: 1131614-84-0 Catalog No: AG00HCNF MDL No:
Product Description
Catalog Number:
AG00HCNF
Chemical Name:
3-Iodo-4-((3-Methylpiperidin-1-yl)Methyl)benzoic acid
CAS Number:
1131614-84-0
IUPAC Name:
3-iodo-4-[(3-methylpiperidin-1-yl)methyl]benzoic acid
InChI:
InChI=1S/C14H18INO2/c1-10-3-2-6-16(8-10)9-12-5-4-11(14(17)18)7-13(12)15/h4-5,7,10H,2-3,6,8-9H2,1H3,(H,17,18)
InChI Key:
MNDHYNZEFOEASI-UHFFFAOYSA-N
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
359.038g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
359.207g/mol
Monoisotopic Mass:
359.038g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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