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125300-69-8 | Thiophene, 3-[(2-ethylhexyl)oxy]-
CAS No: 125300-69-8 Catalog No: AG000NH1 MDL No:
Product Description
Catalog Number:
AG000NH1
Chemical Name:
Thiophene, 3-[(2-ethylhexyl)oxy]-
CAS Number:
125300-69-8
Molecular Formula:
C12H20OS
Molecular Weight:
212.3516
IUPAC Name:
3-(2-ethylhexoxy)thiophene
InChI:
InChI=1S/C12H20OS/c1-3-5-6-11(4-2)9-13-12-7-8-14-10-12/h7-8,10-11H,3-6,9H2,1-2H3
InChI Key:
VYKRLIYPHRWOEN-UHFFFAOYSA-N
SMILES:
CCCCC(COc1cscc1)CC
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.123g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.351g/mol
Monoisotopic Mass:
212.123g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
37.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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