Home Halogens 2-(3,4-dichlorophenyl)-5-methyl-1,3-oxazole-4-carboxylic acid

2-(3,4-dichlorophenyl)-5-methyl-1,3-oxazole-4-carboxylic acid

CAS No.:
1443979-88-1
Catalog Number:
AG01A5WO
Molecular Formula:
C11H7Cl2NO3
Molecular Weight:
272.0842
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Product Description
Catalog Number:
AG01A5WO
Chemical Name:
2-(3,4-dichlorophenyl)-5-methyl-1,3-oxazole-4-carboxylic acid
CAS Number:
1443979-88-1
Molecular Formula:
C11H7Cl2NO3
Molecular Weight:
272.0842
MDL Number:
MFCD07379223
IUPAC Name:
2-(3,4-dichlorophenyl)-5-methyl-1,3-oxazole-4-carboxylic acid
InChI:
InChI=1S/C11H7Cl2NO3/c1-5-9(11(15)16)14-10(17-5)6-2-3-7(12)8(13)4-6/h2-4H,1H3,(H,15,16)
InChI Key:
ULCCLFXRXPQHJE-UHFFFAOYSA-N
SMILES:
OC(=O)c1nc(oc1C)c1ccc(c(c1)Cl)Cl
Properties
Complexity:
302  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.98g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
272.081g/mol
Monoisotopic Mass:
270.98g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties