2,5-Dibromo-3-dodecylthiophene

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Catalog Number
ACM139100064
Product Name
2,5-Dibromo-3-dodecylthiophene
Structure
Structure
CAS
139100-06-4
Category
Bromine Series
Synonyms
2-Bromo-3-dodecylthiophene;2-Bromo-3-laurylthiophene
IUPAC Name
2-bromo-3-dodecylthiophene
Molecular Weight
331.4g/mol
Molecular Formula
C16H27BrS
Canonical SMILES
CCCCCCCCCCCCC1=C(SC=C1)Br
InChI
InChI=1S/C16H27BrS/c1-2-3-4-5-6-7-8-9-10-11-12-15-13-14-18-16(15)17/h13-14H,2-12H2,1H3
InChI Key
IMILVTHOOISGRW-UHFFFAOYSA-N
Complexity
184
Covalently-Bonded Unit Count
1
Exact Mass
330.10168g/mol
Formal Charge
0
H-Bond Acceptor
1
H-Bond Donor
0
Heavy Atom Count
18
Monoisotopic Mass
330.10168g/mol
Rotatable Bond Count
11
XLogP3
8.8
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