W306802
m-Tolualdehyde
Synonym(s):
3-Methylbenzaldehyde
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About This Item
Linear Formula:
CH3C6H4CHO
CAS Number:
Molecular Weight:
120.15
Flavis number:
5.028
PubChem Substance ID:
UNSPSC Code:
12164502
FEMA Number:
3068
EC Number:
210-632-0
MDL number:
Beilstein/REAXYS Number:
741964
biological source
synthetic
refractive index
n20/D 1.541 (lit.)
bp
199 °C (lit.), 80-82 °C/11 mmHg (lit.)
density
1.021 g/mL at 20 °C, 1.019 g/mL at 25 °C (lit.)
application(s)
flavors and fragrances
SMILES string
[H]C(=O)c1cccc(C)c1
InChI
1S/C8H8O/c1-7-3-2-4-8(5-7)6-9/h2-6H,1H3
InChI key
OVWYEQOVUDKZNU-UHFFFAOYSA-N
Storage Class
10 - Combustible liquids
wgk
WGK 3
flash_point_f
181.4 °F - closed cup
flash_point_c
83 °C - closed cup
ppe
Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)
Regulatory Information
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Bi-hong Xiao et al.
Zhong yao cai = Zhongyaocai = Journal of Chinese medicinal materials, 34(4), 544-546 (2011-08-04)
To study the secondary metabolites of coastal seaweed endophytic fungi ZJ27. The compounds were isolated by chromatographic technique. The structures were identified by comprehensive physic-chemical properties and spectral methods. Five compounds were isolated and identified as sclerotiorin (1), ochrephilone (2)
Z P Lin et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 56A(1), 111-117 (2000-03-23)
Triplet-state energy values obtained from the gas phase are still scarce. In this study, the triplet-state energies of 58 aroyl compounds, introduced as gas chromatographic peaks at atmospheric pressure and typically 473 K, have been determined from the 0-0 bands
Anu Vaidyanathan et al.
Journal of toxicology and environmental health. Part A, 66(12), 1133-1143 (2003-06-07)
Xylene is used as a solvent in paints, cleaning agents, and gasoline. Exposure occurs primarily by inhalation. The volatility and lipophilicity of the xylenes make the lung and nasal mucosa the primary target organs. m-Xylene (m-XYL) has been shown to