Name: Name:1,3-Butanedione, 1-[4-(4-chlorophenoxy)phenyl]-4,4,4-trifluoro-
Brand: Angene
SKU: AG00226V
Rating: 90 (10 reviews)

1,3-Butanedione, 1-[4-(4-chlorophenoxy)phenyl]-4,4,4-trifluoro-

CAS No.:

1806473-78-8

Catalog Number:

AG00226V

Molecular Formula:

C16H10ClF3O3

Molecular Weight:

342.6970

Catalog Number:

AG00226V

Chemical Name:

1,3-Butanedione, 1-[4-(4-chlorophenoxy)phenyl]-4,4,4-trifluoro-

CAS Number:

1806473-78-8

Molecular Formula:

C16H10ClF3O3

Molecular Weight:

342.6970

MDL Number:

MFCD28099057

IUPAC Name:

1-[4-(4-chlorophenoxy)phenyl]-4,4,4-trifluorobutane-1,3-dione

InChI:

InChI=1S/C16H10ClF3O3/c17-11-3-7-13(8-4-11)23-12-5-1-10(2-6-12)14(21)9-15(22)16(18,19)20/h1-8H,9H2

InChI Key:

UVAIMBJOOBGHLP-UHFFFAOYSA-N

SMILES:

O=C(c1ccc(cc1)Oc1ccc(cc1)Cl)CC(=O)C(F)(F)F

Complexity:

423

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

342.027g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

342.698g/mol

Monoisotopic Mass:

342.027g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

43.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.7