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306935-18-2 | 2-Furancarboxylic acid, 5-(3,5-dichlorophenoxy)-, methyl ester
CAS No: 306935-18-2 Catalog No: AG0030UY MDL No:MFCD00219587
Product Description
Catalog Number:
AG0030UY
Chemical Name:
2-Furancarboxylic acid, 5-(3,5-dichlorophenoxy)-, methyl ester
CAS Number:
306935-18-2
Molecular Formula:
C12H8Cl2O4
Molecular Weight:
287.0955
MDL Number:
MFCD00219587
IUPAC Name:
methyl 5-(3,5-dichlorophenoxy)furan-2-carboxylate
InChI:
InChI=1S/C12H8Cl2O4/c1-16-12(15)10-2-3-11(18-10)17-9-5-7(13)4-8(14)6-9/h2-6H,1H3
InChI Key:
NPBMLPOXMSWIBA-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(o1)Oc1cc(Cl)cc(c1)Cl
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.98g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.092g/mol
Monoisotopic Mass:
285.98g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
48.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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