Name: Name:7-Bromo-2,3-dihydrobenzo[b][1,4]dioxine-6-carboxylic acid
Brand: Angene
SKU: AG00EC2U
Rating: 90 (10 reviews)

7-Bromo-2,3-dihydrobenzo[b][1,4]dioxine-6-carboxylic acid

CAS No.:

59820-91-6

Catalog Number:

AG00EC2U

Molecular Formula:

C9H7BrO4

Molecular Weight:

259.0535

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United States

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Catalog Number:

AG00EC2U

Chemical Name:

7-Bromo-2,3-dihydrobenzo[b][1,4]dioxine-6-carboxylic acid

CAS Number:

59820-91-6

Molecular Formula:

C9H7BrO4

Molecular Weight:

259.0535

MDL Number:

MFCD00510294

IUPAC Name:

6-bromo-2,3-dihydro-1,4-benzodioxine-7-carboxylic acid

InChI:

InChI=1S/C9H7BrO4/c10-6-4-8-7(13-1-2-14-8)3-5(6)9(11)12/h3-4H,1-2H2,(H,11,12)

InChI Key:

DMPSJWYHZMDSPL-UHFFFAOYSA-N

SMILES:

OC(=O)c1cc2OCCOc2cc1Br

Complexity:

233

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

257.953g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

259.055g/mol

Monoisotopic Mass:

257.953g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9