Name: Name:Benzeneacetic acid, 2,5-dibromo-, 3-bromophenyl ester
Brand: Angene
SKU: AG009CLZ
Rating: 90 (10 reviews)

Benzeneacetic acid, 2,5-dibromo-, 3-bromophenyl ester

CAS No.:

1403991-82-1

Catalog Number:

AG009CLZ

Molecular Formula:

C14H9Br3O2

Molecular Weight:

448.9321

Catalog Number:

AG009CLZ

Chemical Name:

Benzeneacetic acid, 2,5-dibromo-, 3-bromophenyl ester

CAS Number:

1403991-82-1

Molecular Formula:

C14H9Br3O2

Molecular Weight:

448.9321

MDL Number:

MFCD29924766

IUPAC Name:

(3-bromophenyl) 2-(2,5-dibromophenyl)acetate

InChI:

InChI=1S/C14H9Br3O2/c15-10-2-1-3-12(8-10)19-14(18)7-9-6-11(16)4-5-13(9)17/h1-6,8H,7H2

InChI Key:

WAZJNUMRNCZAIW-UHFFFAOYSA-N

SMILES:

Brc1cccc(c1)OC(=O)Cc1cc(Br)ccc1Br

Complexity:

311

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

447.813g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

448.936g/mol

Monoisotopic Mass:

445.815g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

26.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

5.3