944899-27-8 Purity
96%
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Specification
The molecular formula of 7-Chloro-3-chromanone is C9H7ClO2.
The molecular weight of 7-Chloro-3-chromanone is 182.60 g/mol.
The IUPAC name of 7-Chloro-3-chromanone is 7-chloro-4H-chromen-3-one.
The InChI of 7-Chloro-3-chromanone is InChI=1S/C9H7ClO2/c10-7-2-1-6-3-8(11)5-12-9(6)4-7/h1-2,4H,3,5H2.
The InChIKey of 7-Chloro-3-chromanone is GRMNWIUZRITVQF-UHFFFAOYSA-N.
The Canonical SMILES of 7-Chloro-3-chromanone is C1C(=O)COC2=C1C=CC(=C2)Cl.
The CAS number of 7-Chloro-3-chromanone is 944899-60-9.
The molecular weight of 7-Chloro-3-chromanone according to PubChem is 182.60 g/mol.
The XLogP3-AA value of 7-Chloro-3-chromanone is 2.
Yes, 7-Chloro-3-chromanone is a canonicalized compound according to PubChem.