Name: Name:1-(5-bromothiophen-2-yl)-4,4-dimethylpent-1-en-3-one
Brand: Angene
SKU: AG01EM2S
Rating: 90 (10 reviews)

1-(5-bromothiophen-2-yl)-4,4-dimethylpent-1-en-3-one

CAS No.:

1258828-10-2

Catalog Number:

AG01EM2S

Molecular Formula:

C11H13BrOS

Molecular Weight:

273.1893

Catalog Number:

AG01EM2S

Chemical Name:

1-(5-bromothiophen-2-yl)-4,4-dimethylpent-1-en-3-one

CAS Number:

1258828-10-2

Molecular Formula:

C11H13BrOS

Molecular Weight:

273.1893

MDL Number:

MFCD17977094

IUPAC Name:

(E)-1-(5-bromothiophen-2-yl)-4,4-dimethylpent-1-en-3-one

InChI:

InChI=1S/C11H13BrOS/c1-11(2,3)9(13)6-4-8-5-7-10(12)14-8/h4-7H,1-3H3/b6-4+

InChI Key:

ARUJIULLIXAOIU-GQCTYLIASA-N

SMILES:

O=C(C(C)(C)C)C=Cc1ccc(s1)Br

Complexity:

242

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

271.987g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

273.188g/mol

Monoisotopic Mass:

271.987g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

45.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.2