2,6-Dichloropyrimidine-4-carbonyl chloride - CAS 26830-94-4
Catalog: |
BB062862 |
Product Name: |
2,6-Dichloropyrimidine-4-carbonyl chloride |
CAS: |
26830-94-4 |
Synonyms: |
2,6-dichloropyrimidine-4-carbonyl Chloride; 2,6-DICHLOROPYRIMIDINE-4-CARBONYLCHLORIDE |
IUPAC Name: | 2,6-dichloropyrimidine-4-carbonyl chloride |
Description: | 2,6-Dichloropyrimidine-4-carbonyl Chloride, |
Molecular Weight: | 211.43 |
Molecular Formula: | C5HCl3N2O |
Canonical SMILES: | C1=C(N=C(N=C1Cl)Cl)C(=O)Cl |
InChI: | InChI=1S/C5HCl3N2O/c6-3-1-2(4(7)11)9-5(8)10-3/h1H |
InChI Key: | NUYJCMGJLNVOML-UHFFFAOYSA-N |
Complexity: | 166 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 209.915446 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 209.915446 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 42.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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