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144173-99-9 | Hydroperoxide, 1-(2-thienyl)ethyl (9CI)
CAS No: 144173-99-9 Catalog No: AG001J1V MDL No:
Product Description
Catalog Number:
AG001J1V
Chemical Name:
Hydroperoxide, 1-(2-thienyl)ethyl (9CI)
CAS Number:
144173-99-9
Molecular Formula:
C6H8O2S
Molecular Weight:
144.1915
IUPAC Name:
2-(1-hydroperoxyethyl)thiophene
InChI:
InChI=1S/C6H8O2S/c1-5(8-7)6-3-2-4-9-6/h2-5,7H,1H3
InChI Key:
ZDMYTQREKCOHRM-UHFFFAOYSA-N
SMILES:
OOC(c1cccs1)C
Properties
Complexity:
87.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.025g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
144.188g/mol
Monoisotopic Mass:
144.025g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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