Name: Name:3-(8-chloro-2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enoic acid
Brand: Angene
SKU: AG019NXX
Rating: 90 (10 reviews)

3-(8-chloro-2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enoic acid

CAS No.:

851721-93-2

Catalog Number:

AG019NXX

Molecular Formula:

C11H9ClO4

Molecular Weight:

240.6398

Catalog Number:

AG019NXX

Chemical Name:

3-(8-chloro-2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enoic acid

CAS Number:

851721-93-2

Molecular Formula:

C11H9ClO4

Molecular Weight:

240.6398

MDL Number:

MFCD06382851

IUPAC Name:

3-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enoic acid

InChI:

InChI=1S/C11H9ClO4/c12-8-5-7(1-2-10(13)14)6-9-11(8)16-4-3-15-9/h1-2,5-6H,3-4H2,(H,13,14)

InChI Key:

JNDFDEZJZXAHBU-UHFFFAOYSA-N

SMILES:

OC(=O)C=Cc1cc(Cl)c2c(c1)OCCO2

Complexity:

292

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

240.019g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

240.639g/mol

Monoisotopic Mass:

240.019g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2