Name: Name:4,4,4-trifluoro-1-(5-methylfuran-2-yl)butane-1,3-dione
Brand: Angene
SKU: AG01AI0W
Rating: 90 (10 reviews)

4,4,4-trifluoro-1-(5-methylfuran-2-yl)butane-1,3-dione

CAS No.:

779342-39-1

Catalog Number:

AG01AI0W

Molecular Formula:

C9H7F3O3

Molecular Weight:

220.1453

Catalog Number:

AG01AI0W

Chemical Name:

4,4,4-trifluoro-1-(5-methylfuran-2-yl)butane-1,3-dione

CAS Number:

779342-39-1

Molecular Formula:

C9H7F3O3

Molecular Weight:

220.1453

MDL Number:

MFCD03420654

IUPAC Name:

4,4,4-trifluoro-1-(5-methylfuran-2-yl)butane-1,3-dione

InChI:

InChI=1S/C9H7F3O3/c1-5-2-3-7(15-5)6(13)4-8(14)9(10,11)12/h2-3H,4H2,1H3

InChI Key:

DAWIAMPYBTWSLY-UHFFFAOYSA-N

SMILES:

O=C(c1ccc(o1)C)CC(=O)C(F)(F)F

Complexity:

272

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

220.035g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

220.147g/mol

Monoisotopic Mass:

220.035g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

47.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4