Home Other Building Blocks 4-(1-METHYL-PIPERIDIN-4-YLOXY)-BENZOIC ACID ,HYDRO-CHLORIDE

4-(1-METHYL-PIPERIDIN-4-YLOXY)-BENZOIC ACID ,HYDRO-CHLORIDE

CAS No.:
718632-61-2
Catalog Number:
AG01DWMK
Molecular Formula:
C13H18ClNO3
Molecular Weight:
271.7399
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Product Description
Catalog Number:
AG01DWMK
Chemical Name:
4-(1-METHYL-PIPERIDIN-4-YLOXY)-BENZOIC ACID ,HYDRO-CHLORIDE
CAS Number:
718632-61-2
Molecular Formula:
C13H18ClNO3
Molecular Weight:
271.7399
MDL Number:
MFCD19313129
IUPAC Name:
4-(1-methylpiperidin-4-yl)oxybenzoic acid;hydrochloride
InChI:
InChI=1S/C13H17NO3.ClH/c1-14-8-6-12(7-9-14)17-11-4-2-10(3-5-11)13(15)16;/h2-5,12H,6-9H2,1H3,(H,15,16);1H
InChI Key:
MDDOCCNDVQLAER-UHFFFAOYSA-N
SMILES:
CN1CCC(CC1)Oc1ccc(cc1)C(=O)O.Cl
Properties
Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.098g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
271.741g/mol
Monoisotopic Mass:
271.098g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties