(2H3)methanesulfinyl(2H3)methane

• ChemBase编号: 106231
• 分子式: C2H6OS
• 平均质量: 78.13344
• 单一同位素质量: 78.01393581
• SMILES: S(=O)(C)C
• Canonical SMILES: CS(=O)C
• InChI: InChI=1S/C2H6OS/c1-4(2)3/h1-2H3
• InChIKey: IAZDPXIOMUYVGZ-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: (^2H₃)methanesulfinyl(^2H₃)methane; (^2H₃)methanesulfinyl(^2H₃)methane
• IUPAC系统名: (^2H₃)Methanesulfinyl(^2H₃)methane
• IUPAC传统名: deuterated dmso
• 别名: 二甲基亚砜-d6; 氘代二甲亚砜; 二甲亚砜-d6; Methyl sulfoxide-d6; Dimethyl sulfoxide-d; Deuterated dimethyl sulfoxide; Deuterated DMSO; DMSO-d6; (Methyl sulfoxide)-d6; Hexadeuterodimethyl sulfoxide; Dimethyl sulfoxide-d6; DIMETHYL SULFOXIDE [D6, 99.9%]; DIMETHYL SULFOXIDE-D6

登记号

• CAS号: 2206-27-1
• EC号: 218-617-0
• MDL号: MFCD00002090
• Beilstein号: 1237248
• PubChem SID: 24866188; 24868790; 24867389; 24854200; 24867320; 24880509; 24878858; 24866189; 24878927; 24868143; 24866545; 24857840; 24880584; 24849174; 24866518; 24866187; 24880726; 24874254; 24866190; 162087204; 24850540; 24867659; 24854199; 24874246; 24871596; 24882096; 24858692; 24851193; 24849647
• PubChem CID: 75151
• Chemspider ID: 67699
• 维基百科标题: Deuterated_DMSO

理论计算性质

• 质子受体: 1
• 质子供体: 0
• LogD (pH = 5.5): -1.4078656
• LogD (pH = 7.4): -1.4078656
• Log P: -1.4078656
• 摩尔折射率: 20.7254 cm^3
• 极化性: 8.039938 Å^3
• 极化表面积: 17.07 Å^2
• 可自由旋转的化学键: 0
• 里宾斯基五规则: true

分子性质

理化性质

• 溶解度: Minimum isotopic purity 99.96%
• 外观: Liquid; Liquid, in prescored ampoules, 0.75ml/ampoule
• 熔点: 20°C
• 沸点: 189 °C(lit.); 190°C
• 闪点: 188.6 °F; 87 °C; 88°C(190°F)
• 自燃点: 573 °F
• 密度: 1.18; 1.190 g/mL at 25 °C(lit.)
• 折射率: 1.4760; n20/D 1.476(lit.)
• 蒸汽压: 0.42 mmHg ( 20 °C)
• 质量偏移: M+6

安全信息

• 保存注意事项: Hygroscopic
• RTECS编号: PV6210000
• 德国WGK号: 2; 3
• TSCA收录: 否
• 爆炸极限: 42 %
• GHS危险声明: H227
• GHS警示性声明: P210-P280-P370+P378A-P403+P235-P501A
• 个人保护装置: Eyeshields, Gloves, half-mask respirator (US), multi-purpose combination respirator cartridge (US)

产品相关信息

• 纯度: 99.9%; 99.96%
• 级别: anhydrous
• 同位素纯度: 99.5 atom % D; 99.9 atom % D; 99.96 atom % D
• 包装: pk of 10 × 0.25 mL; pk of 10 × 0.5 mL; pk of 10 × 0.6 mL; pk of 10 × 0.75 mL; pk of 10 × 1 mL; pk of 5 × 0.5 mL
• 杂质: <50 ppm water
• 其他组分: 0.03 % (v/v) TMS; 0.1 % (v/v) TMS; 1 % (v/v) TMS
• 线性分子式: (CD3)2SO

详细说明

MP Biomedicals - 02510723

CD₃ SOCD₃
Contains +1% TMS
Purity: 99.9% D atom
d= 1.19 gm/ml

MP Biomedicals - 02510823

CD₃SODC₃
Purity: 99.96% D atom
d-1.19 gm/ml

MP Biomedicals - 02510722

CD₃ SOCD₃
Purity: 99.9% D atom
d= 1.19 gm/ml

Sigma Aldrich - 570672

包装
50 g in glass bottle

Sigma Aldrich - 296147

包装
10 g in ampule
10×0.5, 10×0.6, 10×0.75, 10×1 mL in ampule
25, 50 g in glass bottle

Sigma Aldrich - 437697

包装
10 g in ampule
50 g in glass bottle

Sigma Aldrich - 716731

包装
10×0.75 mL in ampule

Sigma Aldrich - 417920

包装
25 mL in glass bottle

Sigma Aldrich - 417912

包装
10 g in ampule
50 g in glass bottle

Sigma Aldrich - 423653

包装
1 pkg in ampule
10×0.75 mL in ampule

Sigma Aldrich - 424005

包装
1 pkg in ampule

Sigma Aldrich - 156914

包装
1, 5 g in ampule
10×0.5, 10×0.75, 10×1 mL in ampule
25 g in glass bottle

Sigma Aldrich - 547239

包装
10×0.5 mL in ampule
10, 50 mL in serum bottle

Sigma Aldrich - 444766

包装
1 pkg in ampule

Sigma Aldrich - 479071

包装
25 mL in glass bottle
5 mL in ampule

Sigma Aldrich - 308838

包装
1 pkg in ampule

Sigma Aldrich - 185965

包装
10 g in ampule
25, 50 g in glass bottle

Sigma Aldrich - 236934

包装
1 pkg in ampule

Sigma Aldrich - 522120

包装
10, 100 g in glass bottle

Sigma Aldrich - 151874

包装
1 kg in glass bottle
10×0.6, 10×0.75, 10×1 mL in ampule
600 g in glass bottle
10 g in glass bottle
10 g in serum bottle
100 g in Sure/Seal™
25, 50 g in glass bottle
5, 10 g in ampule
50 g in serum bottle

Sigma Aldrich - 453323

包装
1 pkg in ampule

Sigma Aldrich - 612324

Application
These solvents have an HOD peak which is less than 1% of the HOH peak to minimize potential exchange with an analyte. "Special HOH" also meet our standard water specifications for NMR solvents.
包装
10, 25, 50 g in glass bottle

Sigma Aldrich - 522058

包装
1 pkg in ampule

Sigma Aldrich - 569585

包装
10×1 mL in ampule

Sigma Aldrich - 175943

包装
10 g in ampule
50, 100, 250 g in glass bottle

Sigma Aldrich - 236926

包装
1 pkg in ampule
5×1 mL in ampule

Sigma Aldrich - 441392

包装
1 pkg in ampule

Sigma Aldrich - 417904

包装
10, 50 g in glass bottle

Sigma Aldrich - 417939

包装
10×0.75, 5 mL in ampule
25 mL in glass bottle

Sigma Aldrich - 574341

包装
10×0.5, 0×0.6 mL in ampule
10, 50 mL in serum bottle

Sigma Aldrich - 439037

包装
10 g in ampule
25, 50 g in glass bottle

Sigma Aldrich - 545880

包装
1 pkg in ampule