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Home > Aldehydes > 1007197-30-9
1007197-30-9 | 5-Pyrimidinecarboxaldehyde, 2,4-dichloro-6-(methylamino)-
CAS No: 1007197-30-9 Catalog No: AG0002PD MDL No:
Product Description
Catalog Number:
AG0002PD
Chemical Name:
5-Pyrimidinecarboxaldehyde, 2,4-dichloro-6-(methylamino)-
CAS Number:
1007197-30-9
Molecular Formula:
C6H5Cl2N3O
Molecular Weight:
206.0294
IUPAC Name:
2,4-dichloro-6-(methylamino)pyrimidine-5-carbaldehyde
InChI:
InChI=1S/C6H5Cl2N3O/c1-9-5-3(2-12)4(7)10-6(8)11-5/h2H,1H3,(H,9,10,11)
InChI Key:
JBARZLFFRPWUPD-UHFFFAOYSA-N
SMILES:
CNc1nc(Cl)nc(c1C=O)Cl
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.981g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.026g/mol
Monoisotopic Mass:
204.981g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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