2-(5-Chloro-4-formyl-2-methoxyphenoxy)acetamide - CAS 486995-22-6
Catalog: |
BB042714 |
Product Name: |
2-(5-Chloro-4-formyl-2-methoxyphenoxy)acetamide |
CAS: |
486995-22-6 |
Synonyms: |
MLS000662513; SCHEMBL2559619; CHEMBL1529416 |
IUPAC Name: | 2-(5-chloro-4-formyl-2-methoxyphenoxy)acetamide |
Description: | 2-(5-Chloro-4-formyl-2-methoxyphenoxy)acetamide (CAS# 486995-22-6 ) is a useful research chemical. |
Molecular Weight: | 243.64 |
Molecular Formula: | C10H10ClNO4 |
Canonical SMILES: | COC1=C(C=C(C(=C1)C=O)Cl)OCC(=O)N |
InChI: | InChI=1S/C10H10ClNO4/c1-15-8-2-6(4-13)7(11)3-9(8)16-5-10(12)14/h2-4H,5H2,1H3,(H2,12,14) |
InChI Key: | PKTBFTZLCXEFDX-UHFFFAOYSA-N |
Complexity: | 261 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 243.0298355 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 243.0298355 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 78.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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