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1780-38-7 | Pyrimidine, 2,4,6-trichloro-5-ethyl-
CAS No: 1780-38-7 Catalog No: AG0025PQ MDL No:MFCD11112097
Product Description
Catalog Number:
AG0025PQ
Chemical Name:
Pyrimidine, 2,4,6-trichloro-5-ethyl-
CAS Number:
1780-38-7
Molecular Formula:
C6H5Cl3N2
Molecular Weight:
211.4763
MDL Number:
MFCD11112097
IUPAC Name:
2,4,6-trichloro-5-ethylpyrimidine
InChI:
InChI=1S/C6H5Cl3N2/c1-2-3-4(7)10-6(9)11-5(3)8/h2H2,1H3
InChI Key:
KMPDRUUXTSYMJD-UHFFFAOYSA-N
SMILES:
CCc1c(Cl)nc(nc1Cl)Cl
NSC Number:
67799
Properties
Complexity:
121
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.952g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.47g/mol
Monoisotopic Mass:
209.952g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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