1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione

• ChemBase编号: 69895
• 分子式: C10H14N2O5
• 平均质量: 242.22856
• 单一同位素质量: 242.09027156
• SMILES: c1(=O)[nH]c(=O)c(cn1[C@@H]1O[C@@H]([C@H](C1)O)CO)C
• Canonical SMILES: OC[C@H]1O[C@H](C[C@@H]1O)n1cc(C)c(=O)[nH]c1=O
• InChI: InChI=1S/C10H14N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h3,6-8,13-14H,2,4H2,1H3,(H,11,15,16)/t6-,7+,8+/m0/s1
• InChIKey: IQFYYKKMVGJFEH-XLPZGREQSA-N

名称和登记号

名称

• IUPAC标准名: 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
• IUPAC传统名: thymidine
• 别名: 1-(2-脱氧-β-D-呋喃核糖)-5-甲基尿嘧啶; 1-(2-脱氧-β-D-呋喃核糖)胸苷; 2′-脱氧胸苷; 胸腺嘧啶核苷; 胸苷; 1-(2-Deoxy-β-D-ribofuranosyl)-5-methyluracil; 1-(2-Deoxy-β-D-ribofuranosyl)thymine; 2′-Deoxythymidine; Thymine deoxyriboside; Thymidine; dT; 1-((2R,4S,5R)-4-Hydroxy-5-(hydroxymethyl)tetrahydro-furan-2-yl)-5-methylpyrimidine-2,4(1H,3H)-dione

登记号

• CAS号: 50-89-5
• EC号: 200-070-4
• MDL号: MFCD00006537
• Beilstein号: 89285
• PubChem SID: 24900588; 162035620; 24899996
• PubChem CID: 5789

理论计算性质

• Acid pKa: 9.960277
• 质子受体: 5
• 质子供体: 3
• LogD (pH = 5.5): -1.1190685
• LogD (pH = 7.4): -1.1202337
• Log P: -1.1190536
• 摩尔折射率: 55.412 cm^3
• 极化性: 22.001661 Å^3
• 极化表面积: 99.1 Å^2
• 可自由旋转的化学键: 2
• 里宾斯基五规则: true

分子性质

理化性质

• 外观: powder; Powder
• 熔点: 186-188 °C(lit.)
• 比旋光度: [α]25/D +18.5°, c = 1 in H2O

安全信息

• 保存注意事项: IRRITANT
• RTECS编号: XP2071000
• 德国WGK号: 3
• TSCA收录: false
• 个人保护装置: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter

药理学性质

• 相关基因信息: human ... DTYMK(1841)

产品相关信息

• 纯度: ≥99%; 95+%
• 适用性: suitable for cell culture
• 产品线: BioReagent
• Empirical Formula (Hill Notation): C10H14N2O5

详细说明

Sigma Aldrich - T9250

包装
1, 5, 10, 25 g in poly bottle

Sigma Aldrich - T1895

Frequently Asked Questions
Live Chat and Frequently Asked Questions are available for this Product.
Application
Use in HT and HAT cocktails for hybridoma fusion, selection and cloning.