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About This Item
Linear Formula:
C5H9OH
CAS Number:
Molecular Weight:
86.13
Beilstein/REAXYS Number:
1900556
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
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grade
purum
assay
≥99.0% (GC)
refractive index
n20/D 1.453 (lit.)
n20/D 1.453
bp
139-140 °C (lit.)
mp
−19 °C (lit.)
density
0.948 g/mL at 20 °C
0.949 g/mL at 25 °C (lit.)
SMILES string
OC1CCCC1
InChI
1S/C5H10O/c6-5-3-1-2-4-5/h5-6H,1-4H2
InChI key
XCIXKGXIYUWCLL-UHFFFAOYSA-N
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Neepa Choksi et al.
Cutaneous and ocular toxicology, 39(3), 180-192 (2020-06-27)
OptiSafe is an in chemico test method that identifies potential eye irritants based on macromolecular damage following test chemical exposure. The OptiSafe protocol includes a prescreen assessment that identifies test chemicals that are outside the applicability domain of the test
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