Name: Name:4-(3-Chloro-5-fluorophenyl)-3-fluorobenzoic acid
Brand: Angene
SKU: AG000SAB
Rating: 90 (10 reviews)

4-(3-Chloro-5-fluorophenyl)-3-fluorobenzoic acid

CAS No.:

1261970-29-9

Catalog Number:

AG000SAB

Molecular Formula:

C13H7ClF2O2

Molecular Weight:

268.6433

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Purity

Availability

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Price(USD)

Quantity

98%

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United States

$150

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Catalog Number:

AG000SAB

Chemical Name:

4-(3-Chloro-5-fluorophenyl)-3-fluorobenzoic acid

CAS Number:

1261970-29-9

Molecular Formula:

C13H7ClF2O2

Molecular Weight:

268.6433

MDL Number:

MFCD18320999

IUPAC Name:

4-(3-chloro-5-fluorophenyl)-3-fluorobenzoic acid

InChI:

InChI=1S/C13H7ClF2O2/c14-9-3-8(4-10(15)6-9)11-2-1-7(13(17)18)5-12(11)16/h1-6H,(H,17,18)

InChI Key:

VLBASAJZSPEHPF-UHFFFAOYSA-N

SMILES:

Fc1cc(Cl)cc(c1)c1ccc(cc1F)C(=O)O

Complexity:

313

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

268.01g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

268.644g/mol

Monoisotopic Mass:

268.01g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

37.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.9