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Home Other Building Blocks 3-(4-Chlorobenzoyl)propionic acid

3-(4-Chlorobenzoyl)propionic acid

CAS No.:
3984-34-7
Catalog Number:
AG003BA5
Molecular Formula:
C10H9ClO3
Molecular Weight:
212.6297
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$13
- +
5g
96%
In Stock USA
United States
$32
- +
25g
96%
In Stock USA
United States
$100
- +
100g
96%
In Stock USA
United States
$300
- +
Product Description
Catalog Number:
AG003BA5
Chemical Name:
3-(4-Chlorobenzoyl)propionic acid
CAS Number:
3984-34-7
Molecular Formula:
C10H9ClO3
Molecular Weight:
212.6297
MDL Number:
MFCD00002794
IUPAC Name:
4-(4-chlorophenyl)-4-oxobutanoic acid
InChI:
InChI=1S/C10H9ClO3/c11-8-3-1-7(2-4-8)9(12)5-6-10(13)14/h1-4H,5-6H2,(H,13,14)
InChI Key:
AHVASTJJVAYFPY-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)Cl)CCC(=O)O
EC Number:
223-627-3
NSC Number:
5137
Properties
Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.024g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
212.629g/mol
Monoisotopic Mass:
212.024g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Literature
Title Journal
Antimicrobial activities of some synthetic butenolides and their pyrrolone derivatives. Journal of enzyme inhibition and medicinal chemistry 20100201
Properties