Name: Name:1-Propanone,1-(3,5-dichloro-2-hydroxyphenyl)-
Brand: Angene
SKU: AG0075PJ
Rating: 90 (10 reviews)

1-Propanone,1-(3,5-dichloro-2-hydroxyphenyl)-

CAS No.:

18430-74-5

Catalog Number:

AG0075PJ

Molecular Formula:

C9H8Cl2O2

Molecular Weight:

219.0646

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Product Description

Catalog Number:

AG0075PJ

Chemical Name:

1-Propanone,1-(3,5-dichloro-2-hydroxyphenyl)-

CAS Number:

18430-74-5

Molecular Formula:

C9H8Cl2O2

Molecular Weight:

219.0646

MDL Number:

MFCD00218580

IUPAC Name:

1-(3,5-dichloro-2-hydroxyphenyl)propan-1-one

InChI:

InChI=1S/C9H8Cl2O2/c1-2-8(12)6-3-5(10)4-7(11)9(6)13/h3-4,13H,2H2,1H3

InChI Key:

OYUBSDJHAZSFHZ-UHFFFAOYSA-N

SMILES:

CCC(=O)c1cc(Cl)cc(c1O)Cl

Properties

Complexity:

196

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

217.99g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

219.061g/mol

Monoisotopic Mass:

217.99g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

37.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5

Literature

Title	Journal
N'-[(1E)-1-(3,5-Dichloro-2-hy-droxy-phen-yl)propyl-idene]-4-meth-oxy-benzohydrazide monohydrate.	Acta crystallographica. Section E, Structure reports online 20101001

Properties