Home>>Signaling Pathways>> Ox Stress Reagents>> Pro-Oxidant Activity>>Aniline-d5

Aniline-d5 Sale

(Synonyms: 苯胺-2,3,4,5,6-d5) 目录号 : GC49419

An internal standard for the quantification of aniline

Aniline-d5 Chemical Structure

Cas No.:4165-61-1

规格 价格 库存 购买数量
250 mg
500 mg
1 g

Customer Review

Based on customer reviews.

电话:400-920-5774 Email: sales@glpbio.cn

Sample solution is provided at 25 µL, 10mM.


Quality Control & SDS

View current batch:


Aniline-d5 intended for use as an internal standard for the quantification of aniline by GC- or LC-MS. Aniline is an aromatic amine that has been used as a starting material in the synthesis of a wide variety of precursors to dyes and pigments, rubber processing chemicals, and agricultural chemicals.1 It increases the levels of reactive oxygen species (ROS) and malondialdehyde (MDA) and decreases the levels of glutathione and catalase, as well as the activity of superoxide dismutase (SOD), in primary rat hepatocytes when used at concentrations of 5 and 10 µg/ml.2 Aniline (0.3 and 0.6% of the diet) induces splenic sarcomas in rats and is neurotoxic to rats when administered at doses of 750 and 1,000 mg/kg.3,4 Formulations containing aniline have been used in the synthesis of pharmaceuticals.

1.Kahl, T., SchrÖder, K.-Q., Lawrence, F.R., et al.Aniline3465-478(2011) 2.Wang, Y., Gao, H., Na, X.-L., et al.Aniline induces oxidative stress and apoptosis of primary cultured hepatocytesInt. J. Environ. Res. Public Health13(12)1188(2016) 3.Goodman, D.G., Ward, J.M., and Reichardt, W.D.Splenic fibrosis and sarcomas in F344 rats fed diets containing aniline hydrochloride, p-chloroaniline, azobenzene, o-toluidine hydrochloride, 4,4’-sulfonyldianiline, or D & C red No. 9J. Natl. Cancer Inst.73(1)265-273(2019) 4.Okazaki, Y., Yamashita, K., Sudo, M., et al.Neurotoxicity induced by a single oral dose of aniline in ratsJ. Vet. Med. Sci.63(5)539-546(2001)

Chemical Properties

Cas No. 4165-61-1 SDF
别名 苯胺-2,3,4,5,6-d5
Canonical SMILES [2H]C1=C(N)C([2H])=C([2H])C([2H])=C1[2H]
分子式 C6H2D5N 分子量 98.2
溶解度 DMF: 15 mg/ml,DMSO: 10 mg/ml,Ethanol: 3 mg/ml,PBS (pH 7.2): 5 mg/ml 储存条件 -20°C
General tips 请根据产品在不同溶剂中的溶解度选择合适的溶剂配制储备液;一旦配成溶液,请分装保存,避免反复冻融造成的产品失效。
储备液的保存方式和期限:-80°C 储存时,请在 6 个月内使用,-20°C 储存时,请在 1 个月内使用。
Shipping Condition 评估样品解决方案:配备蓝冰进行发货。所有其他可用尺寸:配备RT,或根据请求配备蓝冰。


1 mg 5 mg 10 mg
1 mM 10.1833 mL 50.9165 mL 101.833 mL
5 mM 2.0367 mL 10.1833 mL 20.3666 mL
10 mM 1.0183 mL 5.0916 mL 10.1833 mL
  • 摩尔浓度计算器

  • 稀释计算器

  • 分子量计算器

*在配置溶液时,请务必参考产品标签上、MSDS / COA(可在Glpbio的产品页面获得)批次特异的分子量使用本工具。


动物体内配方计算器 (澄清溶液)

给药剂量 mg/kg 动物平均体重 g 每只动物给药体积 ul 动物数量
% DMSO % % Tween 80 % saline

Research Update

Hydrogen-bonding-induced enhancement of Fermi resonances: a linear IR and nonlinear 2D-IR study of Aniline-d5

J Phys Chem B 2013 Dec 12;117(49):15843-55.PMID:24000972DOI:10.1021/jp4084103.

Hydrogen bonding of the amino group of Aniline-d5 results in a huge enhancement of the NH2 bending overtone absorption strength, mainly attributed to the Fermi resonance effect. A quantitative analysis is presented, using a hybrid mode representation and encompassing experimental data on aniline with 0, 1, or 2 hydrogen bonds to dimethylsulfoxide (DMSO). Changes in enthalpy, hydrogen-bonding-induced frequency shifts, and the transition dipole moment increase of the local N-H stretching oscillator all demonstrate that the hydrogen bond is strongest in the single hydrogen-bonded complex. Linear IR overtone spectra show that the oscillator strength decreases upon hydrogen bonding for the N-H stretching overtones, which is opposite to the effect on the fundamental N-H stretching transitions. Polarization resolved 2D-IR spectra provide detailed information on the N-H stretching overtone manifold and support the relative orientations of the various IR transitions.

Synthesis of deuterium-labeled 2-quinoxalinecarboxylic acid and 3-methylquinoxaline-2-carboxylic acid from deuterium aniline

J Labelled Comp Radiopharm 2018 Dec;61(14):1043-1047.PMID:30132955DOI:10.1002/jlcr.3679.

An efficient and simple synthetic route of deuterium-labeled 2-quinoxalinecarboxylic acid-d4 (QCA-d4 ) and 3-methylquinoxaline-2-carboxylic acid-d4 (MQCA-d4 ) is presented with 99.9% and 99.6% isotopic enrichment using Aniline-d5 as labeled starting material. Their chemical structures were confirmed by 1 H NMR, and their isotopic abundance was determined by mass spectrometry analysis.

Hydrogen bonding induced enhancement of Fermi resonances: ultrafast vibrational energy flow dynamics in aniline-d₅

J Phys Chem B 2015 Feb 12;119(6):2711-25.PMID:25393885DOI:10.1021/jp509977r.

With hydrogen bonding of the amino group of Aniline-d5 we can identify the roles of Fermi enhanced combination and overtone states in intramolecular vibrational re-distribution (IVR) pathways for N-H stretching excitations. Using linear Fourier transform infrared (FT-IR) spectroscopy, ultrafast one- and two-color IR-pump-IR-probe spectroscopy, and femtosecond two-dimensional IR spectroscopy, we can identify the primary accepting modes for N-H stretching excitations. In particular, a key role is played by the δ(NH2) bending degree of freedom, either via its δ = 2 overtone state or via a combination state with the ν(C═C) ring stretching mode. No significant transient population in these Fermi enhanced combination/overtone states can be observed, a consequence of similar decay rates of these Fermi enhanced combination/overtone states and of the N-H stretching states. A similar magnitude of the transient response of the two fingerprint modes regardless of direct excitation of the Fermi enhanced combination/overtone levels or of the N-H stretching states suggests an underlying coupling mechanism facilitating common IVR pathways. This mechanism is expected to be of general importance for other organic compounds with hydrogen-bonded amino groups, including DNA bases.