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144363-63-3 | Acetic acid, 1,1',1''-[(2-phenylethynyl)plumbanetriyl] ester
CAS No: 144363-63-3 Catalog No: AG001JEE MDL No:
Product Description
Catalog Number:
AG001JEE
Chemical Name:
Acetic acid, 1,1',1''-[(2-phenylethynyl)plumbanetriyl] ester
CAS Number:
144363-63-3
Molecular Formula:
C14H14O6Pb
Molecular Weight:
485.4574
IUPAC Name:
[diacetyloxy(2-phenylethynyl)plumbyl] acetate
InChI:
InChI=1S/C8H5.3C2H4O2.Pb/c1-2-8-6-4-3-5-7-8;3*1-2(3)4;/h3-7H;3*1H3,(H,3,4);/q;;;;+3/p-3
InChI Key:
IZDVLOBVUBCSTG-UHFFFAOYSA-K
SMILES:
CC(=O)O[Pb](OC(=O)C)(OC(=O)C)C#Cc1ccccc1
Properties
Complexity:
439
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
486.056g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
485.46g/mol
Monoisotopic Mass:
486.056g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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