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Structure

Methyl alpha,gamma,epsilon-trioxobenzenehexanoate

CAS
76798-27-1
Catalog Number
ACM76798271
Category
Other Products
Molecular Weight
248.231380 [g/mol]
Molecular Formula
C13H12O5

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Specification

Synonyms
EINECS 278-552-9, Methyl alpha,gamma,epsilon-trioxobenzenehexanoate, 76798-27-1
IUPAC Name
methyl 2,4,6-trioxo-6-phenylhexanoate
Canonical SMILES
COC(=O)C(=O)CC(=O)CC(=O)C1=CC=CC=C1
InChI Key
UHBQYIPCSNKCFU-UHFFFAOYSA-N
Boiling Point
372.5ºC at 760 mmHg
Flash Point
165.2ºC
Density
1.233g/cm³
EC Number
278-552-9
Exact Mass
248.06800
H-Bond Acceptor
5
H-Bond Donor
0
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