trichloro(2H)methane

• ChemBase编号: 106228
• 分子式: CHCl3
• 平均质量: 119.37764
• 单一同位素质量: 117.91438307
• SMILES: C(Cl)(Cl)Cl
• Canonical SMILES: ClC(Cl)Cl
• InChI: InChI=1S/CHCl3/c2-1(3)4/h1H
• InChIKey: HEDRZPFGACZZDS-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: trichloro(^2H)methane; trichloro(^2H)methane
• IUPAC传统名: deuterated chloroform
• 别名: 氘代氯仿; 氯仿-d; 氘代氯仿-d; Chloroform-d; Chloroform-d; Deuterated chloroform; CHLOROFORM [D1]; CHLOROFORM-D; Deuterochloroform; CHLOROFORM [D, 99.8%]

登记号

• CAS号: 865-49-6
• EC号: 212-742-4
• MDL号: MFCD00000827
• Beilstein号: 1697633
• PubChem SID: 24866519; 24868784; 24868141; 24880586; 24872890; 24867214; 24854197; 24866473; 24882093; 24877772; 24867654; 24874242; 24849171; 24865925; 24872891; 24854198; 24880507; 162094243; 24849168; 24849167; 24858686; 24867055; 24853521
• PubChem CID: 71583
• Chemspider ID: 64654
• 维基百科标题: Deuterated_chloroform

理论计算性质

• 质子受体: 0
• 质子供体: 0
• LogD (pH = 5.5): 1.8253005
• LogD (pH = 7.4): 1.8253005
• Log P: 1.8253005
• 摩尔折射率: 21.3673 cm^3
• 极化性: 8.372397 Å^3
• 极化表面积: 0.0 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

• 外观: Liquid; Liquid in prescored ampoules, 0.75ml/ampoule
• 熔点: -64 °C(lit.); -64°C; -64°C
• 沸点: 60.9 °C(lit.); 61°C; 62°C
• 密度: 1.50; 1.500 g cm^-3; 1.500 g/mL at 25 °C(lit.)
• 折射率: 1.4445; n20/D 1.444(lit.)
• 质量偏移: M+1

安全信息

• 保存注意事项: Moisture & Light Sensitive
• 欧盟危险性物质标志: X; 有害性(Harmful) (Xn)
• 联合国危险货物编号: 1888; UN1888
• 德国WGK号: 3
• 联合国危险货物等级: 6.1
• 联合国危险货物包装类别(PG): 3; III
• 危险公开号: 22-38-40-48/20/22; R22, R38, R40, R48/20/22
• 安全公开号: 2-36/37; 36/37; S36/37
• TSCA收录: 否
• GHS危险品标识: GHS06; GHS07; GHS08
• GHS警示词: Warning
• NFPA704:
  

  0

  2

  0
• GHS危险声明: H300-H315-H351-H373-H333; H302-H315-H351-H373; H351-H373-H302-H315
• GHS警示性声明: P260-P280-P302+P352-P321-P405-P501A; P260-P301+P310-P302+P352-P321-P405-P501A; P281
• 个人保护装置: Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US)
• RID/ADR: UN 1888 6.1/PG 3

产品相关信息

• 纯度: 100% (Isotopic); 100% (Isotopic), contains 0.03% v/v TMS; 99.8%; 99.8% (Isotopic); 99.8% (Isotopic), contains 0.03% v/v TMS; 99.8% (Isotopic), contains 1% v/v TMS; 99.96%
• 级别: anhydrous
• 同位素纯度: 100 atom % D; 99.8 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: <10 ppm water
• 其他组分: 0.03 % (v/v) TMS; 0.05 % (v/v) TMS; 0.1 % (v/v) TMS; 0.5 wt. % silver foil as stabilizer; 0.5 wt. % silver wire as stabilizer; 1 % (v/v) TMS
• 线性分子式: CDCl3

详细说明

MP Biomedicals - 02510811

CDCl₃
Purity: 99.96% D atom.
d=1.50 gm/ml
Poison, UN 1888

MP Biomedicals - 02510709

CDCl₃
Contains ±1% TMS.
Purity: 99.8% D atom.
d= 1.50 gm/ml
Poison, UN 1888

MP Biomedicals - 02510710

CDCl₃
Purity: 99.8% D atom.
d= 1.50 gm/ml
Poison, UN 1888

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包装
1 pkg in ampule

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包装
100 g in glass bottle

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1 pkg in ampule

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1 pkg in ampule
安瓿瓶包装

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包装
10×1 mL in ampule
500 g in glass bottle
150 g in Sure/Seal™
50, 100 g in glass bottle

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

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包装
150 g in Sure/Seal™
50, 100 g in glass bottle
250 g in glass bottle

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100 g in glass bottle
150 g in Sure/Seal™
500 g in glass bottle

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1 pkg in ampule

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1 pkg in ampule

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包装
100, 250 g in glass bottle

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包装
10 g in ampule
10×0.75 mL in ampule
50 g in glass bottle

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包装
5×0.5 mL in ampule

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包装
1 pkg in ampule

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包装
1, 1.5 kg in glass bottle
10×0.6, 10×0.75, 10×1 mL in ampule
250 g in glass bottle
150 g in Sure/Seal™
50, 100 g in glass bottle

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包装
50 g in Sure/Seal™

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包装
100, 250 g in glass bottle

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包装
10 mL in ampule
50 mL in glass bottle

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包装
1 pkg in ampule