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ar-(Allyloxy)benzenetrimethanol

HCID 116458
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Basic information

CAS
10580-81-1
Standard SMILES
C=CCOc1c(CO)cc(CO)cc1CO
InChIKey
LCZGQAGYKBQHKZ-UHFFFAOYSA-N
Molecular formula
C12H16O4
Average molar mass
224.256 g/mol
Monoisotopic mass
224.10485899

Names & identifiers

Preferred name
ar-(Allyloxy)benzenetrimethanol
IUPAC
{2-[(Prop-2-en-1-yl)oxy]benzene-1,3,5-triyl}trimethanol
English name
2,4,6-Trimethylolphenyl allyl ether
Molecular formula
C12H16O4
Molecular weight
224.25

Names & synonyms

2-Allyloxy-1,3,5-benzenetrimethanol2,4,6-Trimethylolphenyl allyl ether1-Allyloxy-2,4,6-tris(hydroxymethyl)benzene1,3,5-Benzenetrimethanol, 2-(2-propen-1-yloxy)-

Database identifiers

CAS
10580-81-1、64051-40-7
PubChem CID
116458
DTXSID
DTXSID3070040
UNII
344IQY6Z2O
EC Number
264-632-0
Nikkaji
J76.647J

Properties

Physicochemical properties

Melting point
86 · 86.0-86.2 °C(Solv: ethyl acetate (141-78-6))
Boiling point
427.7 · 427.7±40.0 °C(Predicted)
Density
1.225 · 1.225±0.06 g/cm3(Predicted)
pka
13.97 · 13.97±0.10(Predicted)
FDA UNII
344 IQY6Z2O · 344IQY6Z2O

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