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About This Item
Empirical Formula (Hill Notation):
C8H12O4
CAS Number:
Molecular Weight:
172.18
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
95%
Form:
liquid
InChI
1S/C8H12O4/c1-2-12-7(11)8(6(9)10)4-3-5-8/h2-5H2,1H3,(H,9,10)
SMILES string
CCOC(=O)C1(CCC1)C(O)=O
InChI key
XYHZRSFKDSWLHW-UHFFFAOYSA-N
assay
95%
form
liquid
refractive index
n20/D 1.451
density
1.117 g/mL at 25 °C
functional group
carboxylic acid, ester
signalword
Warning
hcodes
Hazard Classifications
Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
10 - Combustible liquids
wgk
WGK 3
flash_point_f
>230.0 °F - closed cup
flash_point_c
> 110 °C - closed cup
Regulatory Information
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