101803-03-6
中文名称
2-脱氧-N-乙基鸟苷
英文名称
N2-ETHYL-2'-DEOXYGUANOSINE
CAS
101803-03-6
分子式
C12H17N5O4
分子量
295.29
MOL 文件
101803-03-6.mol
101803-03-6 结构式
基本信息
中文别名
2-脱氧-N-乙基鸟苷N2-乙基-2'-脱氧鸟苷
英文别名
N2-Et-dG2'-Deoxy-N-ethylguanosine
N2-ETHYL-2'-DEOXYGUANOSINE
N2-Ethyl-2’-deoxy guanosine
Guanosine,2'-deoxy-N-ethyl-
Guanosine, 2'-deoxy-N-ethyl-
2-(ethylamino)-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one
2-(Ethylamino)-9-((2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-1H-purin-6(9H)-one
物理化学性质
熔点240-242 °C (decomp)
密度1.764±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
储存条件2-8°C
溶解度H2O: >5mg/mL
酸度系数(pKa)10.620±0.10(predicted)
形态solid
颜色white to off-white
水溶解性H2O: >5mg/mL
InChI1S/C12H17N5O4/c1-2-13-12-15-10-9(11(20)16-12)14-5-17(10)8-3-6(19)7(4-18)21-8/h5-8,18-19H,2-4H2,1H3,(H2,13,15,16,20)/t6-,7+,8+/m0/s1
InChIKeyVOKQFDULHQUWAV-XLPZGREQSA-N
SMILESCCNC1=Nc2c(ncn2[C@H]3C[C@H](O)[C@@H](CO)O3)C(=O)N1
安全数据
危险品标志T+
危险类别码26/27/28-33-40
安全说明36/37/39-45
危险品运输编号UN 2811 6.1 / PGI
WGK Germany3
海关编码2934999090
存储类别6.1A - Combustible acute toxic Cat. 1 and 2
very toxic hazardous materials
very toxic hazardous materials
危险性类别Acute Tox. 2 Dermal
Acute Tox. 2 Inhalation
Acute Tox. 2 Oral
Carc. 2
STOT RE 2
Acute Tox. 2 Inhalation
Acute Tox. 2 Oral
Carc. 2
STOT RE 2