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Home Carbonyls 5-Methoxy-3-[4-(piperidinocarbonyl)phenyl]benzoic acid

5-Methoxy-3-[4-(piperidinocarbonyl)phenyl]benzoic acid

CAS No.:
1261969-11-2
Catalog Number:
AG000S93
Molecular Formula:
C20H21NO4
Molecular Weight:
339.3850
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$100
- +
5g
96%
In Stock USA
United States
$300
- +
Product Description
Catalog Number:
AG000S93
Chemical Name:
5-Methoxy-3-[4-(piperidinocarbonyl)phenyl]benzoic acid
CAS Number:
1261969-11-2
Molecular Formula:
C20H21NO4
Molecular Weight:
339.3850
MDL Number:
MFCD18323032
IUPAC Name:
3-methoxy-5-[4-(piperidine-1-carbonyl)phenyl]benzoic acid
InChI:
InChI=1S/C20H21NO4/c1-25-18-12-16(11-17(13-18)20(23)24)14-5-7-15(8-6-14)19(22)21-9-3-2-4-10-21/h5-8,11-13H,2-4,9-10H2,1H3,(H,23,24)
InChI Key:
SHYRKVICVFHZQC-UHFFFAOYSA-N
SMILES:
COc1cc(cc(c1)C(=O)O)c1ccc(cc1)C(=O)N1CCCCC1
Properties
Complexity:
466  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.147g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
339.391g/mol
Monoisotopic Mass:
339.147g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties