22051
Carvacrol
purum, ≥97.0% (GC)
Synonym(s):
5-Isopropyl-2-methylphenol
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About This Item
Linear Formula:
(CH3)2CHC6H3(CH3)OH
CAS Number:
Molecular Weight:
150.22
EC Number:
207-889-6
UNSPSC Code:
12352100
PubChem Substance ID:
Beilstein/REAXYS Number:
1860514
MDL number:
grade
purum
assay
≥97.0% (GC)
refractive index
n20/D 1.522 (lit.), n20/D 1.523
bp
236-237 °C (lit.)
mp
3-4 °C (lit.)
density
0.976 g/mL at 20 °C (lit.)
SMILES string
CC(C)c1ccc(C)c(O)c1
InChI
1S/C10H14O/c1-7(2)9-5-4-8(3)10(11)6-9/h4-7,11H,1-3H3
InChI key
RECUKUPTGUEGMW-UHFFFAOYSA-N
Gene Information
human ... UGT1A4(54657)
Disclaimer
may discolor to yellow on storage
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signalword
Danger
hcodes
Hazard Classifications
Acute Tox. 4 Oral - Aquatic Chronic 2 - Eye Dam. 1 - Skin Corr. 1B
Storage Class
8A - Combustible corrosive hazardous materials
wgk
WGK 3
flash_point_f
>212.0 °F
flash_point_c
> 100 °C
ppe
Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
Regulatory Information
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Andreas Leffler et al.
Molecular pain, 7, 62-62 (2011-08-25)
Low concentrations of local anesthetics (LAs) suppress cellular excitability by inhibiting voltage-gated Na⁺ channels. In contrast, LAs at high concentrations can be excitatory and neurotoxic. We recently demonstrated that LA-evoked activation of sensory neurons is mediated by the capsaicin receptor
Transient receptor potential ankyrin 1 (TRPA1) channel as emerging target for novel analgesics and anti-inflammatory agents.
Pier Giovanni Baraldi et al.
Journal of medicinal chemistry, 53(14), 5085-5107 (2010-04-02)
Josefin Larsson et al.
Journal of natural products, 68(7), 985-991 (2005-07-26)
Recently various attempts have been made to increase the efficacy and precision of chemical libraries used in high-throughput screening (HTS) drug discovery approaches. One such approach is ChemGPS, which provides a defined chemical space for prescreening evaluation of chemical compound