Home Halogens 1-[(5-chlorothiophen-2-yl)methyl]piperidine-4-carboxylic acid

1-[(5-chlorothiophen-2-yl)methyl]piperidine-4-carboxylic acid

CAS No.:
1156269-60-1
Catalog Number:
AG019XNQ
Molecular Formula:
C11H14ClNO2S
Molecular Weight:
259.7524
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Product Description
Catalog Number:
AG019XNQ
Chemical Name:
1-[(5-chlorothiophen-2-yl)methyl]piperidine-4-carboxylic acid
CAS Number:
1156269-60-1
Molecular Formula:
C11H14ClNO2S
Molecular Weight:
259.7524
MDL Number:
MFCD12169802
IUPAC Name:
1-[(5-chlorothiophen-2-yl)methyl]piperidine-4-carboxylic acid
InChI:
InChI=1S/C11H14ClNO2S/c12-10-2-1-9(16-10)7-13-5-3-8(4-6-13)11(14)15/h1-2,8H,3-7H2,(H,14,15)
InChI Key:
CQTOEYZFHGTGIF-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCN(CC1)Cc1ccc(s1)Cl
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.043g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
259.748g/mol
Monoisotopic Mass:
259.043g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
68.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties