4-Chloro-1-ethyl-1H-pyrazole-3-carbaldehyde - CAS 1005583-83-4
Catalog: |
BB045525 |
Product Name: |
4-Chloro-1-ethyl-1H-pyrazole-3-carbaldehyde |
CAS: |
1005583-83-4 |
Synonyms: |
4-chloro-1-ethyl-1H-pyrazole-3-carbaldehyde |
IUPAC Name: | 4-chloro-1-ethylpyrazole-3-carbaldehyde |
Description: | 4-Chloro-1-ethyl-1H-pyrazole-3-carbaldehyde (CAS# 1005583-83-4 ) is a useful research chemical. |
Molecular Weight: | 158.58 |
Molecular Formula: | C6H7ClN2O |
Canonical SMILES: | CCN1C=C(C(=N1)C=O)Cl |
InChI: | InChI=1S/C6H7ClN2O/c1-2-9-3-5(7)6(4-10)8-9/h3-4H,2H2,1H3 |
InChI Key: | YTXOJJRIMZRRMH-UHFFFAOYSA-N |
Purity: | > 95 % |
Complexity: | 131 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 158.0246905 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 158.0246905 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 34.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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