Name: Name:3-Thiophenecarboxylic acid, 4,5-dibromo-
Brand: Angene
SKU: AG0003NV
Rating: 90 (10 reviews)

3-Thiophenecarboxylic acid, 4,5-dibromo-

CAS No.:

101079-66-7

Catalog Number:

AG0003NV

Molecular Formula:

C5H2Br2O2S

Molecular Weight:

285.9412

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Product Description

Catalog Number:

AG0003NV

Chemical Name:

3-Thiophenecarboxylic acid, 4,5-dibromo-

CAS Number:

101079-66-7

Molecular Formula:

C5H2Br2O2S

Molecular Weight:

285.9412

MDL Number:

MFCD01006724

IUPAC Name:

4,5-dibromothiophene-3-carboxylic acid

InChI:

InChI=1S/C5H2Br2O2S/c6-3-2(5(8)9)1-10-4(3)7/h1H,(H,8,9)

InChI Key:

ARYZJCDPKDFHPT-UHFFFAOYSA-N

SMILES:

OC(=O)c1csc(c1Br)Br

Properties

Complexity:

153

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

285.812g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

285.937g/mol

Monoisotopic Mass:

283.814g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

65.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501