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Home Aminos 3-[(3-Chloro-4-methylphenyl)amino]-3-oxopropanoic acid

3-[(3-Chloro-4-methylphenyl)amino]-3-oxopropanoic acid

CAS No.:
73877-03-9
Catalog Number:
AG005W6O
Molecular Formula:
C10H10ClNO3
Molecular Weight:
227.6443
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
- +
5g
95%
In Stock USA
United States
$216
- +
Product Description
Catalog Number:
AG005W6O
Chemical Name:
3-[(3-Chloro-4-methylphenyl)amino]-3-oxopropanoic acid
CAS Number:
73877-03-9
Molecular Formula:
C10H10ClNO3
Molecular Weight:
227.6443
MDL Number:
MFCD08685830
IUPAC Name:
3-(3-chloro-4-methylanilino)-3-oxopropanoic acid
InChI:
InChI=1S/C10H10ClNO3/c1-6-2-3-7(4-8(6)11)12-9(13)5-10(14)15/h2-4H,5H2,1H3,(H,12,13)(H,14,15)
InChI Key:
TUKUCIWNZGJPRL-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(c(c1)Cl)C)CC(=O)O
Properties
Complexity:
257  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.035g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
227.644g/mol
Monoisotopic Mass:
227.035g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties