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16019-33-3 | 5-Pyrimidineacetaldehyde, 4,6-dichloro-
CAS No: 16019-33-3 Catalog No: AG001RQL MDL No:MFCD09991563
Product Description
Catalog Number:
AG001RQL
Chemical Name:
5-Pyrimidineacetaldehyde, 4,6-dichloro-
CAS Number:
16019-33-3
Molecular Formula:
C6H4Cl2N2O
Molecular Weight:
191.0148
MDL Number:
MFCD09991563
IUPAC Name:
2-(4,6-dichloropyrimidin-5-yl)acetaldehyde
InChI:
InChI=1S/C6H4Cl2N2O/c7-5-4(1-2-11)6(8)10-3-9-5/h2-3H,1H2
InChI Key:
QEBITPOSBYZLCY-UHFFFAOYSA-N
SMILES:
O=CCc1c(Cl)ncnc1Cl
Properties
Complexity:
135
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.97g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.011g/mol
Monoisotopic Mass:
189.97g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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