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Home Carbonyls 3-[3-(N,N-Dimethylaminocarbonyl)phenyl]-5-methoxybenzoic acid

3-[3-(N,N-Dimethylaminocarbonyl)phenyl]-5-methoxybenzoic acid

CAS No.:
1261907-71-4
Catalog Number:
AG000S5C
Molecular Formula:
C17H17NO4
Molecular Weight:
299.3212
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$250
- +
1g
95%
In Stock USA
United States
$525
- +
Product Description
Catalog Number:
AG000S5C
Chemical Name:
3-[3-(N,N-Dimethylaminocarbonyl)phenyl]-5-methoxybenzoic acid
CAS Number:
1261907-71-4
Molecular Formula:
C17H17NO4
Molecular Weight:
299.3212
MDL Number:
MFCD18321954
IUPAC Name:
3-[3-(dimethylcarbamoyl)phenyl]-5-methoxybenzoic acid
InChI:
InChI=1S/C17H17NO4/c1-18(2)16(19)12-6-4-5-11(7-12)13-8-14(17(20)21)10-15(9-13)22-3/h4-10H,1-3H3,(H,20,21)
InChI Key:
OXSSFYRDUCQHEX-UHFFFAOYSA-N
SMILES:
COc1cc(cc(c1)C(=O)O)c1cccc(c1)C(=O)N(C)C
Properties
Complexity:
410  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.116g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
299.326g/mol
Monoisotopic Mass:
299.116g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties