Name: Name:Thieno[3,4-b]thiophene-2-carboxylic acid, 4,6-dibromo-3-fluoro-, octyl ester
Brand: Angene
SKU: AG000BKL
Rating: 90 (10 reviews)

Thieno[3,4-b]thiophene-2-carboxylic acid, 4,6-dibromo-3-fluoro-, octyl ester

CAS No.:

1160823-76-6

Catalog Number:

AG000BKL

Molecular Formula:

C15H17Br2FO2S2

Molecular Weight:

472.2307

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

100mg

>94.0%(GC)

1 week

United States

$532

- +

Catalog Number:

AG000BKL

Chemical Name:

Thieno[3,4-b]thiophene-2-carboxylic acid, 4,6-dibromo-3-fluoro-, octyl ester

CAS Number:

1160823-76-6

Molecular Formula:

C15H17Br2FO2S2

Molecular Weight:

472.2307

MDL Number:

MFCD19440962

IUPAC Name:

octyl 4,6-dibromo-3-fluorothieno[2,3-c]thiophene-2-carboxylate

InChI:

InChI=1S/C15H17Br2FO2S2/c1-2-3-4-5-6-7-8-20-15(19)12-10(18)9-11(21-12)14(17)22-13(9)16/h2-8H2,1H3

InChI Key:

AXLMQOPQPUEOQD-UHFFFAOYSA-N

SMILES:

CCCCCCCCOC(=O)c1sc2c(c1F)c(sc2Br)Br

Complexity:

376

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

471.9g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

472.225g/mol

Monoisotopic Mass:

469.902g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

82.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

8.4