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46052-84-0 | 1,4-Benzenedicarboxaldehyde, 2,5-dichloro-
CAS No: 46052-84-0 Catalog No: AG006XGG MDL No:
Product Description
Catalog Number:
AG006XGG
Chemical Name:
1,4-Benzenedicarboxaldehyde, 2,5-dichloro-
CAS Number:
46052-84-0
Molecular Formula:
C8H4Cl2O2
Molecular Weight:
203.0222
IUPAC Name:
2,5-dichloroterephthalaldehyde
InChI:
InChI=1S/C8H4Cl2O2/c9-7-1-5(3-11)8(10)2-6(7)4-12/h1-4H
InChI Key:
XBCGIUJJUZHWMC-UHFFFAOYSA-N
SMILES:
O=Cc1cc(Cl)c(cc1Cl)C=O
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.959g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.018g/mol
Monoisotopic Mass:
201.959g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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