Name: Name:9-bromo-3,4-dihydro-2H-1,5-benzodioxepine-7-carbaldehyde
Brand: Angene
SKU: AG019MVW
Rating: 90 (10 reviews)

9-bromo-3,4-dihydro-2H-1,5-benzodioxepine-7-carbaldehyde

CAS No.:

1094419-43-8

Catalog Number:

AG019MVW

Molecular Formula:

C10H9BrO3

Molecular Weight:

257.0807

Catalog Number:

AG019MVW

Chemical Name:

9-bromo-3,4-dihydro-2H-1,5-benzodioxepine-7-carbaldehyde

CAS Number:

1094419-43-8

Molecular Formula:

C10H9BrO3

Molecular Weight:

257.0807

MDL Number:

MFCD11182039

IUPAC Name:

6-bromo-3,4-dihydro-2H-1,5-benzodioxepine-8-carbaldehyde

InChI:

InChI=1S/C10H9BrO3/c11-8-4-7(6-12)5-9-10(8)14-3-1-2-13-9/h4-6H,1-3H2

InChI Key:

JSTNBWSNINMCAN-UHFFFAOYSA-N

SMILES:

O=Cc1cc2OCCCOc2c(c1)Br

Complexity:

210

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:

2.1