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Home Carboxys 5-[(piperidin-1-yl)methyl]furan-2-carboxylic acid hydrochloride

5-[(piperidin-1-yl)methyl]furan-2-carboxylic acid hydrochloride

CAS No.:
302354-24-1
Catalog Number:
AG01EMUH
Molecular Formula:
C11H16ClNO3
Molecular Weight:
245.7026
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Product Description
Catalog Number:
AG01EMUH
Chemical Name:
5-[(piperidin-1-yl)methyl]furan-2-carboxylic acid hydrochloride
CAS Number:
302354-24-1
Molecular Formula:
C11H16ClNO3
Molecular Weight:
245.7026
MDL Number:
MFCD00573792
IUPAC Name:
5-(piperidin-1-ylmethyl)furan-2-carboxylic acid;hydrochloride
InChI:
InChI=1S/C11H15NO3.ClH/c13-11(14)10-5-4-9(15-10)8-12-6-2-1-3-7-12;/h4-5H,1-3,6-8H2,(H,13,14);1H
InChI Key:
PBIPCZNDEUOIAS-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(o1)CN1CCCCC1.Cl
Properties
Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.082g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
245.703g/mol
Monoisotopic Mass:
245.082g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
53.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties