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About This Item
Empirical Formula (Hill Notation):
C13H20O2
CAS Number:
Molecular Weight:
208.30
Council of Europe no.:
424
FEMA Number:
2251
UNSPSC Code:
12164502
PubChem Substance ID:
EC Number:
202-583-9
Flavis number:
9.143
MDL number:
refractive index
n20/D 1.474
bp
78-80 °C/0.2 mmHg (lit.)
density
0.952 g/mL at 25 °C (lit.)
application(s)
flavors and fragrances
documentation
see Safety & Documentation for available documents
food allergen
no known allergens
organoleptic
minty; sweet
SMILES string
CCC(=O)OC1CC(CC=C1C)C(C)=C
InChI
1S/C13H20O2/c1-5-13(14)15-12-8-11(9(2)3)7-6-10(12)4/h6,11-12H,2,5,7-8H2,1,3-4H3
InChI key
DFVXNZOMAOGTBL-UHFFFAOYSA-N
biological source
synthetic
grade
Kosher
reg. compliance
FDA 21 CFR 172.515
assay
≥97%
optical activity
[α]20/D −107°, neat
Storage Class
10 - Combustible liquids
wgk
WGK 3
flash_point_f
226.4 °F - closed cup
flash_point_c
108.00 °C - closed cup
ppe
Eyeshields, Gloves
Regulatory Information
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