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Home Carbonyls 4-[(Cyclopropylcarbonyl)amino]benzoic acid

4-[(Cyclopropylcarbonyl)amino]benzoic acid

CAS No.:
23745-26-8
Catalog Number:
AG00BFAO
Molecular Formula:
C11H11NO3
Molecular Weight:
205.2099
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$44
- +
250mg
98%
In Stock USA
United States
$57
- +
1g
98%
In Stock USA
United States
$125
- +
5g
98%
In Stock USA
United States
$375
- +
10g
98%
In Stock USA
United States
$744
- +
25g
98%
In Stock USA
United States
$1125
- +
Product Description
Catalog Number:
AG00BFAO
Chemical Name:
4-[(Cyclopropylcarbonyl)amino]benzoic acid
CAS Number:
23745-26-8
Molecular Formula:
C11H11NO3
Molecular Weight:
205.2099
MDL Number:
MFCD02602219
IUPAC Name:
4-(cyclopropanecarbonylamino)benzoic acid
InChI:
InChI=1S/C11H11NO3/c13-10(7-1-2-7)12-9-5-3-8(4-6-9)11(14)15/h3-7H,1-2H2,(H,12,13)(H,14,15)
InChI Key:
RXFRECYQSDDFRO-UHFFFAOYSA-N
SMILES:
O=C(C1CC1)Nc1ccc(cc1)C(=O)O
Properties
Complexity:
265  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.074g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
205.213g/mol
Monoisotopic Mass:
205.074g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Literature
Title Journal
4-(Cyclo-propane-carboxamido)-benzoic acid. Acta crystallographica. Section E, Structure reports online 20121001
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties