Name: Name:2,5-Cyclohexadiene-1,4-dione, 2-bromo-5-methyl-
Brand: Angene
SKU: AG000UU6
Rating: 90 (10 reviews)

2,5-Cyclohexadiene-1,4-dione, 2-bromo-5-methyl-

CAS No.:

13070-25-2

Catalog Number:

AG000UU6

Molecular Formula:

C7H5BrO2

Molecular Weight:

201.0174

Catalog Number:

AG000UU6

Chemical Name:

2,5-Cyclohexadiene-1,4-dione, 2-bromo-5-methyl-

CAS Number:

13070-25-2

Molecular Formula:

C7H5BrO2

Molecular Weight:

201.0174

IUPAC Name:

2-bromo-5-methylcyclohexa-2,5-diene-1,4-dione

InChI:

InChI=1S/C7H5BrO2/c1-4-2-7(10)5(8)3-6(4)9/h2-3H,1H3

InChI Key:

GELQQGMYSDRBHC-UHFFFAOYSA-N

SMILES:

CC1=CC(=O)C(=CC1=O)Br

Complexity:

261

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

199.947g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

201.019g/mol

Monoisotopic Mass:

199.947g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

34.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8