6-Chlorochromone-3-propionic acid

Base Information

• Chemical Name: 6-Chlorochromone-3-propionic acid
• CAS No.: 890090-65-0
• Molecular Formula: C12H9ClO4
• Molecular Weight: 252.65
• Hs Code.: 2932999099
• European Community (EC) Number: 693-789-1
• DSSTox Substance ID: DTXSID80584696
• Wikidata: Q82476389
• Mol file: 890090-65-0.mol

Synonyms:6-Chlorochromone-3-propionic acid;890090-65-0;3-(6-chloro-4-oxochromen-3-yl)propanoic acid;3-(6-Chloro-4-oxo-4H-chromen-3-yl)propanoic acid;DTXSID80584696;MFCD08276791;AKOS002674432;6-Chlorochromone-3-propionic acid, 96%;3-(6-Chloro-4-oxo-4H-1-benzopyran-3-yl)propanoic acid

Chemical Property of 6-Chlorochromone-3-propionic acid

Chemical Property:

• Melting Point: 178-182 °C
• PSA: 67.51000
• LogP: 2.46360
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 252.0189365
• Heavy Atom Count: 17
• Complexity: 364

Purity/Quality:

98%Min ^*data from raw suppliers

6-Chlorochromone-3-propionic acid 96% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 22-36/37/38
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C=C1Cl)C(=O)C(=CO2)CCC(=O)O