Search Result : Detailed Informations

Low Mol Weight Allergen Name CAS# CID
6-Methylcoumarin 92-48-8 7092
Structure Other Information
Canonical SMILES CC1=CC2=C(C=C1)OC(=O)C=C2
Iso SMILES CC1=CC2=C(C=C1)OC(=O)C=C2
InChI InChI=1S/C10H8O2/c1-7-2-4-9-8(6-7)3-5-10(11)12-9/h2-6H,1H3
InChI Key FXFYOPQLGGEACP-UHFFFAOYSA-N
Formula C10H8O2
Mol Weight 160.169
XlogP3 1.8
Charge 0

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Synonyms Information
CAS Name 6-methyl-1-benzopyran-2-one
IUPAC Name 6-methylchromen-2-one
Openeye Name 6-methylchromen-2-one
Systematic Name 6-methylchromen-2-one
Tratitional Name 6-methylchromen-2-one