8.14893
α-Phellandrene
for synthesis
Synonym(s):
α-Phellandrene, 5-Isopropyl-2-methyl-1,3-cyclohexadiene
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About This Item
Empirical Formula (Hill Notation):
C10H16
CAS Number:
Molecular Weight:
136.23
UNSPSC Code:
12352002
EC Index Number:
202-792-5
NACRES:
NA.22
MDL number:
Quality Level
form
liquid
potency
5700 mg/kg LD50, oral (Rat)
concentration
≥60.0% (GC)
bp
175 °C/1013 hPa
transition temp
flash point 47 °C
density
0.84 g/cm3 at 20 °C
storage temp.
2-30°C
SMILES string
[C@@H]1(CC=C(C=C1)C)C(C)C
InChI
1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4-6,8,10H,7H2,1-3H3/t10-/m1/s1
InChI key
OGLDWXZKYODSOB-SNVBAGLBSA-N
Analysis Note
Assay (GC, area%): ≥ 60.0 % (a/a)
Density (d 20 °C/ 4 °C): 0.835 - 0.850
Density (d 20 °C/ 4 °C): 0.835 - 0.850
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signalword
Danger
Hazard Classifications
Aquatic Chronic 2 - Asp. Tox. 1 - Flam. Liq. 3 - Repr. 2 - Skin Irrit. 2 - Skin Sens. 1
Storage Class
3 - Flammable liquids
wgk
WGK 3
flash_point_f
116.6 °F
flash_point_c
47 °C
Certificates of Analysis (COA)
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