Home Other Building Blocks 3-(dipropylcarbamoyl)benzoic acid

3-(dipropylcarbamoyl)benzoic acid

CAS No.:
126926-35-0
Catalog Number:
AG01AAM5
Molecular Formula:
C14H19NO3
Molecular Weight:
249.3056
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Product Description
Catalog Number:
AG01AAM5
Chemical Name:
3-(dipropylcarbamoyl)benzoic acid
CAS Number:
126926-35-0
Molecular Formula:
C14H19NO3
Molecular Weight:
249.3056
MDL Number:
MFCD12070341
IUPAC Name:
3-(dipropylcarbamoyl)benzoic acid
InChI:
InChI=1S/C14H19NO3/c1-3-8-15(9-4-2)13(16)11-6-5-7-12(10-11)14(17)18/h5-7,10H,3-4,8-9H2,1-2H3,(H,17,18)
InChI Key:
BEOWTCBXKHFAAK-UHFFFAOYSA-N
SMILES:
CCCN(C(=O)c1cccc(c1)C(=O)O)CCC
Properties
Complexity:
285  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.136g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
249.31g/mol
Monoisotopic Mass:
249.136g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties