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Merck
CN

689319

Dehydroacetic acid

99.0-100.3 % (w/w) (T)

Synonym(s):

2-Acetyl-5-hydroxy-3-oxo-4-hexenoic acid δ-lactone

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About This Item

Empirical Formula (Hill Notation):
C8H8O4
CAS Number:
Molecular Weight:
168.15
EC Number:
208-293-9
UNSPSC Code:
12352100
MDL number:
Beilstein/REAXYS Number:
6129
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form

crystalline, powder

manufacturer/tradename

Lonza Ltd

concentration

99.0-100.3 % (w/w) (T)

bp

270 °C (lit.)

mp

109.0-111.0 °C (opt. transm.), 111-113 °C (lit.)

SMILES string

CC(=O)C1C(=O)OC(C)=CC1=O

InChI

1S/C8H8O4/c1-4-3-6(10)7(5(2)9)8(11)12-4/h3,7H,1-2H3

InChI key

PGRHXDWITVMQBC-UHFFFAOYSA-N

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Analysis Note

transparence: >63.2%; 420 nm, 10 mm 1g/30 mL MeOH

pictograms

Exclamation mark

signalword

Warning

hcodes

Hazard Classifications

Acute Tox. 4 Oral

Storage Class

13 - Non Combustible Solids

wgk

WGK 1

flash_point_f

314.6 °F

flash_point_c

157 °C

ppe

dust mask type N95 (US), Eyeshields, Faceshields, Gloves

Regulatory Information

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