Home Halogens 2,5-Dibromo-3-decylthiophene

2,5-Dibromo-3-decylthiophene

CAS No.:
158956-23-1
Catalog Number:
AG001R1X
Molecular Formula:
C14H22Br2S
Molecular Weight:
382.1975
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
>97.0%(GC)
1 week
United States
$578
- +
25g
>97.0%(GC)
1 week
United States
$1575
- +
Product Description
Catalog Number:
AG001R1X
Chemical Name:
2,5-Dibromo-3-decylthiophene
CAS Number:
158956-23-1
Molecular Formula:
C14H22Br2S
Molecular Weight:
382.1975
MDL Number:
MFCD00274314
IUPAC Name:
2,5-dibromo-3-decylthiophene
InChI:
InChI=1S/C14H22Br2S/c1-2-3-4-5-6-7-8-9-10-12-11-13(15)17-14(12)16/h11H,2-10H2,1H3
InChI Key:
CQDSRZZKSUNTSB-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCc1cc(sc1Br)Br
Properties
Complexity:
187  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
381.979g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
382.198g/mol
Monoisotopic Mass:
379.981g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.8  
Literature
Title Journal
Prediction of genotoxicity of chemical compounds by statistical learning methods. Chemical research in toxicology 20050601
Properties