Structure

Pyratrione

CAS
51089-21-5
Catalog Number
ACM51089215
Category
Other Products
Molecular Weight
274.271
Molecular Formula
C15H14O5

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Specification

Synonyms
Pyratrione, CID3084962, 2H-Pyran-2,4(3H)-dione, 3-(3-(3-hydroxyphenyl)-1-oxopropyl)-6-methyl-, 51089-21-5
IUPAC Name
3-[3-(3-hydroxyphenyl)propanoyl]-6-methylpyran-2,4-dione
Canonical SMILES
CC1=CC(=O)C(C(=O)O1)C(=O)CCC2=CC(=CC=C2)O
InChI Key
KSORIVRRDUCFKQ-UHFFFAOYSA-N
Boiling Point
507ºC at 760mmHg
Flash Point
193.2ºC
Density
1.314g/cm³
Exact Mass
274.08400
H-Bond Acceptor
5
H-Bond Donor
1
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