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177343-17-8 | Thiophene, 3-[[(6-bromohexyl)oxy]methyl]-
CAS No: 177343-17-8 Catalog No: AG002591 MDL No:
Product Description
Catalog Number:
AG002591
Chemical Name:
Thiophene, 3-[[(6-bromohexyl)oxy]methyl]-
CAS Number:
177343-17-8
Molecular Formula:
C11H17BrOS
Molecular Weight:
277.2211
IUPAC Name:
3-(6-bromohexoxymethyl)thiophene
InChI:
InChI=1S/C11H17BrOS/c12-6-3-1-2-4-7-13-9-11-5-8-14-10-11/h5,8,10H,1-4,6-7,9H2
InChI Key:
UHSPDOLKLLPZAO-UHFFFAOYSA-N
SMILES:
BrCCCCCCOCc1cscc1
Properties
Complexity:
133
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.018g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.22g/mol
Monoisotopic Mass:
276.018g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
37.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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