[1-(methylsulfanyl)ethylidene]amino N-methyl-N-[(3-methyl-6-oxo-5-oxa-2-thia-4,7-diazaoct-3-en-7-yl)sulfanyl]carbamate

• ChemBase编号: 157931
• 分子式: C10H18N4O4S3
• 平均质量: 354.46932
• 单一同位素质量: 354.04901808
• SMILES: C/C(=N\OC(=O)N(SN(C(=O)O/N=C(/SC)\C)C)C)/SC
• Canonical SMILES: CS/C(=N/OC(=O)N(SN(C(=O)O/N=C(/SC)\C)C)C)/C
• InChI: InChI=1S/C10H18N4O4S3/c1-7(19-5)11-17-9(15)13(3)21-14(4)10(16)18-12-8(2)20-6/h1-6H3
• InChIKey: XDOTVMNBCQVZKG-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: [1-(methylsulfanyl)ethylidene]amino N-methyl-N-[(3-methyl-6-oxo-5-oxa-2-thia-4,7-diazaoct-3-en-7-yl)sulfanyl]carbamate; (E)-[1-(methylsulfanyl)ethylidene]amino N-methyl-N-{[(3E)-3-methyl-6-oxo-5-oxa-2-thia-4,7-diazaoct-3-en-7-yl]sulfanyl}carbamate
• IUPAC传统名: [1-(methylsulfanyl)ethylidene]amino N-methyl-N-[(3-methyl-6-oxo-5-oxa-2-thia-4,7-diazaoct-3-en-7-yl)sulfanyl]carbamate; thiodicarb
• 别名: 硫双灭多威; Thiodicarb; 2,4,8-Trimethyl-5-oxo-6-oxa-3,9-dithia-2,4,7-triazadec-7-enoic Acid [1-(Methylthio)ethylidene]azanyl Ester; N,N'-[Thiobis[(methylimino)carbonyloxy]]bisethanimidothioic Acid Dimethyl Ester; Bismethomyl Thioether; CGA 45156; Dicarbasulf; Larvin; Lepicron; Liushuanwei; Semevin; UC 51762; Thiodicarb

登记号

• CAS号: 59669-26-0
• EC号: 261-848-7
• MDL号: MFCD00145401
• PubChem SID: 162252067; 24899130; 24861197
• PubChem CID: 9601227

理论计算性质

• 质子受体: 4
• 质子供体: 0
• LogD (pH = 5.5): 2.4745958
• LogD (pH = 7.4): 2.4745996
• Log P: 2.4745998
• 摩尔折射率: 84.666 cm^3
• 极化性: 33.803707 Å^3
• 极化表面积: 83.8 Å^2
• 可自由旋转的化学键: 8
• 里宾斯基五规则: true

分子性质

安全信息

• RTECS编号: KJ4301050
• 欧盟危险性物质标志: 剧毒(Highly toxic) (T+)
• 联合国危险货物编号: 2811
• 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): 2
• 危险公开号: 25-26
• 安全公开号: 28-36/37-45
• GHS危险品标识: GHS06; GHS09
• GHS警示词: Danger
• GHS危险声明: H301-H330-H400
• GHS警示性声明: P260-P273-P284-P310
• 个人保护装置: Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges
• RID/ADR: UN 2811 6.1/PG 2

产品相关信息

• 级别: analytical standard; PESTANAL®, analytical standard
• 包装: ampule of 250 mg
• Empirical Formula (Hill Notation): C10H18N4O4S3

详细说明

Sigma Aldrich - 34375

法律信息
PESTANAL 注册商标 Sigma-Aldrich Laborchemikalien GmbH

Toronto Research Chemicals - T344680

Thiodicarb is used as an insecticide.

参考文献

• Sousa, A.A., et al.: J. Econ. Entomol., 70, 803 (1977)
• Armes, N., et al.: Pesticide Sci., 34, 355 (1977)