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131428-36-9 | Thallium, [1-(ethoxycarbonyl)-2,4-cyclopentadien-1-yl]-
CAS No: 131428-36-9 Catalog No: AG000W5P MDL No:
Product Description
Catalog Number:
AG000W5P
Chemical Name:
Thallium, [1-(ethoxycarbonyl)-2,4-cyclopentadien-1-yl]-
CAS Number:
131428-36-9
Molecular Formula:
C8H9O2Tl
Molecular Weight:
341.5392
IUPAC Name:
(1-ethoxycarbonylcyclopenta-2,4-dien-1-yl)thallium
InChI:
InChI=1S/C8H9O2.Tl/c1-2-10-8(9)7-5-3-4-6-7;/h3-6H,2H2,1H3;
InChI Key:
PCUIIPMGSSMBRI-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1([Tl])C=CC=C1
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.035g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
341.538g/mol
Monoisotopic Mass:
342.035g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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