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47798

Supelco

4-Chlorotoluene

analytical standard

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About This Item

Fórmula lineal:
CH3C6H4Cl
Número de CAS:
106-43-4
Peso molecular:
126.58
Beilstein/REAXYS Number:
1903635
EC Number:
203-397-0
MDL number:
MFCD00000631
UNSPSC Code:
12000000
PubChem Substance ID:
24871434

grade

analytical standard

vapor density

4.38 (vs air)

vapor pressure

10 mmHg ( 45 °C)

packaging

ampule of 1000 mg

technique(s)

HPLC: suitable
gas chromatography (GC): suitable

refractive index

n20/D 1.52 (lit.)

bp

162 °C (lit.)

mp

6-8 °C (lit.)

density

1.07 g/mL at 25 °C (lit.)

application(s)

environmental

format

neat

storage temp.

room temp

SMILES string

Cc1ccc(Cl)cc1

InChI

1S/C7H7Cl/c1-6-2-4-7(8)5-3-6/h2-5H,1H3

InChI key

NPDACUSDTOMAMK-UHFFFAOYSA-N

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Application

Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

signalword

Warning

Hazard Classifications

Acute Tox. 4 Inhalation - Aquatic Chronic 2 - Flam. Liq. 3 - Skin Sens. 1

Storage Class

3 - Flammable liquids

wgk_germany

WGK 2

flash_point_f

123.8 °F - closed cup

flash_point_c

51 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

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Certificados de análisis (COA)

Lot/Batch Number
LC17228V
LC13251V
LC02588V
LB87027V
LB77898

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T Zewdie et al.
Journal of toxicology and environmental health, 50(2), 159-172 (1997-02-07)
Treatment of rats with p-chlorotoluene (PCT, 1 g/kg, ip) resulted in peak PCT blood and lung concentrations at 4 h, which declined to very low levels at 12 h. The concentration of PCT in the liver attained its highest value
C Arunagiri et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 79(5), 1747-1756 (2011-06-18)
The FT-IR and FT-Raman spectra of 2-bromo-4-chlorotoluene (2B4CT) molecule have been recorded in the region 4000-400 cm(-1) and 3500-50 cm(-1), respectively. Optimized geometrical structures, harmonic vibrational frequencies, intensities, reduced mass, force constants and depolarization ratio have been computed by the
T Nishio et al.
Applied microbiology and biotechnology, 55(3), 321-325 (2001-05-09)
p-Cymene monooxygenase (CMO) from Pseudomonas putida F1 consists of a hydroxylase (CymA1) and a reductase component (CymA2) which initiate pcymene (p-isopropyltoluene) catabolism by oxidation of the methyl group to p-isopropylbenzyl alcohol (p-cumic alcohol). To study the possible diverse range of
Ya-Jun Liu et al.
Physical chemistry chemical physics : PCCP, 7(23), 3938-3942 (2005-12-07)
Equilibrium geometries and vibrational frequencies of the ground and some excited states of p-chlorotoluene were calculated by the complete active space self-consistent field (CASSCF) method. Multi-reference CASSCF second order perturbation theory (MSCASPT2) calculations were performed on the vertical excitation energies
Mannar R Maurya et al.
Dalton transactions (Cambridge, England : 2003), (32)(32), 4220-4232 (2008-08-07)
3-Formylsalicylic acid (Hfsal), covalently bound to chloromethylated polystyrene (PS) and cross-linked with 5% divinylbenzene reacts with d,l-alanine and l-isoleucine to give the Schiff-base tridentate ligands PS-H(2)fsal-d,l-Ala and PS-H(2)fsal-l-Ile, respectively. These anchored ligands upon reaction with VOSO(4) and Cu(CH(3)COO)(2).H(2)O form the
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