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3421-67-8 | 2,3,5,6-tetrachlorobenzene-1,4-dicarbaldehyde
CAS No: 3421-67-8 Catalog No: AG007H1Y MDL No:
Product Description
Catalog Number:
AG007H1Y
Chemical Name:
2,3,5,6-tetrachlorobenzene-1,4-dicarbaldehyde
CAS Number:
3421-67-8
Molecular Formula:
C8H2Cl4O2
Molecular Weight:
271.9123
IUPAC Name:
2,3,5,6-tetrachloroterephthalaldehyde
InChI:
InChI=1S/C8H2Cl4O2/c9-5-3(1-13)6(10)8(12)4(2-14)7(5)11/h1-2H
InChI Key:
HJTJOWBGKFNDFZ-UHFFFAOYSA-N
SMILES:
O=Cc1c(Cl)c(Cl)c(c(c1Cl)Cl)C=O
NSC Number:
103717
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.878g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.902g/mol
Monoisotopic Mass:
269.881g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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