2,5-Dibromo-3-n-octylthiophene
Catalog Number
ACM149703844-1
CAS
149703-84-4
IUPAC Name
2,5-Dibromo-3-octylthiophene
Synonyms
4-Fluoro-2-trifluoromethylphenyl isothio
Molecular Weight
354.15
Molecular Formula
C12H18Br2S
Product Information
Canonical SMILES
CCCCCCCCC1=C(SC(=C1)Br)Br
InChI
InChI=1S/C12H18Br2S/c1-2-3-4-5-6-7-8-10-9-11(13)15-12(10)14/h9H,2-8H2,1H3
InChI Key
PJGBSUPPENVFAD-UHFFFAOYSA-N
Boiling Point
316 °C
Flash Point
230 °F
Purity
95%+
Density
1.44 g/mL at 25 °C (lit.)
Solubility
Slightly soluble in water
Appearance
Liquid
Storage
2-8 °C
Complexity
164
Covalently-Bonded Unit Count
1
Exact Mass
353.94755
Heavy Atom Count
15
Monoisotopic Mass
351.9496
Refractive Index
n20/D 1.548 (lit.)
Rotatable Bond Count
7
Topological Polar Surface Area
28.2 Ų
Please kindly note that our products and services are for research use only.
Have a question? Get a Free Consultation