Name: Name:Ethanone, 2-bromo-1-(2,3-dihydro-1,4-benzodioxin-2-yl)-
Brand: Angene
SKU: AG0004F2
Rating: 90 (10 reviews)

Ethanone, 2-bromo-1-(2,3-dihydro-1,4-benzodioxin-2-yl)-

CAS No.:

1014-18-2

Catalog Number:

AG0004F2

Molecular Formula:

C10H9BrO3

Molecular Weight:

257.0807

Catalog Number:

AG0004F2

Chemical Name:

Ethanone, 2-bromo-1-(2,3-dihydro-1,4-benzodioxin-2-yl)-

CAS Number:

1014-18-2

Molecular Formula:

C10H9BrO3

Molecular Weight:

257.0807

MDL Number:

MFCD04972619

IUPAC Name:

2-bromo-1-(2,3-dihydro-1,4-benzodioxin-3-yl)ethanone

InChI:

InChI=1S/C10H9BrO3/c11-5-7(12)10-6-13-8-3-1-2-4-9(8)14-10/h1-4,10H,5-6H2

InChI Key:

XHYCSCBAALGUBR-UHFFFAOYSA-N

SMILES:

BrCC(=O)C1COc2c(O1)cccc2

Complexity:

219

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

255.974g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

257.083g/mol

Monoisotopic Mass:

255.974g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

35.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2