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About This Item
Empirical Formula (Hill Notation):
C13H22O2
CAS Number:
Molecular Weight:
210.31
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
250-863-4
MDL number:
Assay:
≥97.0% (GC)
Form:
liquid
Quality Segment
assay
≥97.0% (GC)
form
liquid
density
0.995 g/mL at 20 °C
functional group
aldehyde, hydroxyl
storage temp.
2-8°C
SMILES string
[H]C(=O)C1CCC(CCCC(C)(C)O)=CC1
InChI
1S/C13H22O2/c1-13(2,15)9-3-4-11-5-7-12(10-14)8-6-11/h5,10,12,15H,3-4,6-9H2,1-2H3
InChI key
ORMHZBNNECIKOH-UHFFFAOYSA-N
Storage Class
10 - Combustible liquids
wgk
WGK 2
flash_point_f
275.2 °F
flash_point_c
135.1 °C
ppe
Eyeshields, Gloves
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