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448206

Sigma-Aldrich

p-Cresol-d8

≥98 atom % D, ≥98% (CP)

Synonym(s):

4-Methylphenol-d8

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About This Item

Linear Formula:
CD3C6D4OD
CAS Number:
190780-66-6
Molecular Weight:
116.19
MDL number:
MFCD00145073
UNSPSC Code:
12352202
PubChem Substance ID:
24868392

isotopic purity

≥98 atom % D

Quality Level

200

Assay

≥98% (CP)
99% (CP)

refractive index

n20/D 1.537 (lit.)

bp

202 °C (lit.)

mp

32-34 °C (lit.)

density

1.126 g/mL at 25 °C (lit.)

application(s)

environmental

mass shift

M+8

SMILES string

[2H]Oc1c([2H])c([2H])c(c([2H])c1[2H])C([2H])([2H])[2H]

InChI

1S/C7H8O/c1-6-2-4-7(8)5-3-6/h2-5,8H,1H3/i1D3,2D,3D,4D,5D/hD

InChI key

IWDCLRJOBJJRNH-IWRLGKISSA-N

Packaging

This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

Signal Word

Danger

Hazard Classifications

Acute Tox. 2 Inhalation - Acute Tox. 3 Dermal - Acute Tox. 3 Oral - Aquatic Chronic 2 - Eye Dam. 1 - Skin Corr. 1B

Storage Class Code

6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials

WGK

WGK 2

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

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Certificates of Analysis (COA)

Lot/Batch Number
MBBC5050
MBBB6493V
MBBB4613V
MBBB4008V
MBBB1574V

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Natsuki Ikematsu et al.
Legal medicine (Tokyo, Japan), 34, 27-35 (2018-08-14)
In some forensic autopsy cases there are high concentrations of p-cresol in the blood. In vivo, p-cresol is the only isomer yielded by intestinal bacteria and is excreted into urine. We investigated the diagnostic meaning of p-cresol in the blood
Martin Oppegård et al.
Rapid communications in mass spectrometry : RCM, 34(24), e8950-e8950 (2020-09-19)
Produced water (PW) discharge from the oil and gas industry represents the largest intentional marine waste volume. Alkyl phenols (APs) are one of the main toxic component groups found in PW, with concentration of APs in discharged PW from the

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