磺胺间二甲氧嘧啶 [155-91-9]
- 中文名称：
- 磺胺间二甲氧嘧啶 [155-91-9]
- 中文别名：
- 磺胺间二甲氧嘧啶
- 英文名称：
- Benzenesulfonamide,4-amino-N-(4,6-dimethoxy-2-pyrimidinyl)-
- 英文别名：
- 4-amino-N-(4,6-dimethoxypyrimidin-2-yl)benzenesulfonamide;
Sulphamoprine;
4-amino-N-(4,6-dimethoxy-pyrimidin-2-yl)-benzenesulfonamide;
SDmP;
Sulfadimethoxypyrimidine;
Sulphadimethoxypyrimidine;
sulfanilic acid-(4,6-dimethoxy-pyrimidin-2-ylamide);
2-p-Aminobenzenesulfonamido-4,6-dimethoxypyrimidine;
sulphadimethoxine;
sulfadimethoxine;
ICI 3435;
Sulfamoprine;
6-(p-aminobenzenesulphonamido)-2,4-dimethoxypyrimidine;
Sulfanilsaeure-(4,6-dimethoxy-pyrimidin-2-ylamid)
- CAS No.：
- 155-91-9
- 分 子 式：
-
C12H14N4O4S
- 分 子 量：
- 310.32900
- 精确分子量：
- 310.07400
- PSA：
- 124.81000
- InChI：
- The Key: RMSFTZDTJHYIFE-UHFFFAOYSA-N3
- 风险术语：
- R36/37/38; R43
- 分子结构式：
-
- SDS：
- 查看
磺胺间二甲氧嘧啶 [155-91-9] 制备方法及用途
制备方法
磺胺间二甲氧嘧啶原料药功能用作抗菌药。
用途简介
用途
用作抗菌药。
磺胺间二甲氧嘧啶 [155-91-9] 物化性质
- 密度：
- 1.441g/cm3
- 熔点：
- 200ºC
- 沸点：
- 570.7ºC at 760 mmHg
- 闪点：
- 298.9ºC
- 折射率：
- 1.622
- 蒸汽压：
- 4.92E-13mmHg at 25°C
磺胺间二甲氧嘧啶 [155-91-9] 安全信息
- 海关代码：
- 2935009090
- 危险类别码：
- 36/37/38-43
- 安全说明：
- 26-36/37-24/25-23
- 危险标志：
- Xi
磺胺间二甲氧嘧啶 [155-91-9] 毒理性
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- DA9495000
- CHEMICAL NAME :
- Benzenesulfonamide,
4-amino-N-(4,6-dimethoxy-2-pyrimidinyl)-
- CAS REGISTRY NUMBER :
- 155-91-9
- BEILSTEIN REFERENCE NO. :
- 0307123
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 7
- MOLECULAR FORMULA :
- C12-H14-N4-O4-S
- MOLECULAR WEIGHT :
- 310.36
- WISWESSER LINE NOTATION :
- T6N CNJ BMSWR DZ& DO1 FO1
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Unreported
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 28 gm/kg/28D-I
- TOXIC EFFECTS :
- Liver - hepatitis (hepatocellular necrosis), zonal
Blood - normocytic anemia
Related to Chronic Data - death
- REFERENCE :
- BJPCAL British Journal of Pharmacology and Chemotherapy. (London, UK)
V.1-33, 1946-68. For publisher information, see BJPCBM.
Volume(issue)/page/year: 2,149,1947
** REPRODUCTIVE DATA **
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 538 mg/kg
- SEX/DURATION :
- female 1-22 day(s) after conception
lactating female 21 day(s) post-birth
- TOXIC EFFECTS :
- Reproductive - Specific Developmental Abnormalities - craniofacial
(including nose and tongue)
Reproductive - Effects on Newborn - physical
- REFERENCE :
- BJPCAL British Journal of Pharmacology and Chemotherapy. (London, UK)
V.1-33, 1946-68. For publisher information, see BJPCBM.
Volume(issue)/page/year: 23,305,1964
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 1 gm/kg
- SEX/DURATION :
- female 14 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Specific Developmental Abnormalities - musculoskeletal system
Reproductive - Effects on Newborn - stillbirth
- REFERENCE :
- BJPCAL British Journal of Pharmacology and Chemotherapy. (London, UK)
V.1-33, 1946-68. For publisher information, see BJPCBM.
Volume(issue)/page/year: 23,305,1964
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 825 mg/kg
- SEX/DURATION :
- female 1-22 day(s) after conception
lactating female 21 day(s) post-birth
- TOXIC EFFECTS :
- Reproductive - Effects on Newborn - weaning or lactation index (e.g., #
alive at weaning per # alive at day 4)
- REFERENCE :
- BJPCAL British Journal of Pharmacology and Chemotherapy. (London, UK)
V.1-33, 1946-68. For publisher information, see BJPCBM.
Volume(issue)/page/year: 23,305,1964
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 500 mg/kg
- SEX/DURATION :
- female 11-20 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Specific Developmental Abnormalities - skin and skin
appendages
- REFERENCE :
- EXPEAM Experientia. (Birkhaeuser Verlag, POB 133, CH-4010 Basel,
Switzerland) V.1- 1945- Volume(issue)/page/year: 21,151,1965
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 2520 mg/kg
- SEX/DURATION :
- female 1-22 day(s) after conception
lactating female 21 day(s) post-birth
- TOXIC EFFECTS :
- Reproductive - Effects on Newborn - stillbirth
Reproductive - Effects on Newborn - weaning or lactation index (e.g., #
alive at weaning per # alive at day 4)
- REFERENCE :
- BJPCAL British Journal of Pharmacology and Chemotherapy. (London, UK)
V.1-33, 1946-68. For publisher information, see BJPCBM.
Volume(issue)/page/year: 23,305,1964
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 2520 mg/kg
- SEX/DURATION :
- female 1-22 day(s) after conception
lactating female 21 day(s) post-birth
- TOXIC EFFECTS :
- Reproductive - Specific Developmental Abnormalities - eye/ear
Reproductive - Specific Developmental Abnormalities - craniofacial
(including nose and tongue)
Reproductive - Specific Developmental Abnormalities - musculoskeletal system
- REFERENCE :
- BJPCAL British Journal of Pharmacology and Chemotherapy. (London, UK)
V.1-33, 1946-68. For publisher information, see BJPCBM.
Volume(issue)/page/year: 23,305,1964
磺胺间二甲氧嘧啶 [155-91-9] 海关数据
中国海关编码：2935009090
- 概述：
- 2935009090 其他磺（酰）胺. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:6.5% 普通关税:35.0%
- 申报要素：
- 品名, 成分含量, 用途
- 摘要/Summary：
- 2935009090 other sulphonamides VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:35.0%
磺胺间二甲氧嘧啶 [155-91-9] 分子结构与计算化学数据
分子结构数据
1、 摩尔折射率：75.87
2、 摩尔体积（cm3/mol）：215.2
3、 等张比容（90.2K）：621.6
4、 表面张力（dyne/cm）：69.5
5、 极化率（10-24cm3）：30.07
计算化学数据
1.疏水参数计算参考值（XlogP）:无
2.氢键供体数量:2
3.氢键受体数量:8
4.可旋转化学键数量:5
5.互变异构体数量:2
6.拓扑分子极性表面积125
7.重原子数量:21
8.表面电荷:0
9.复杂度:408
10.同位素原子数量:0
11.确定原子立构中心数量:0
12.不确定原子立构中心数量:0
13.确定化学键立构中心数量:0
14.不确定化学键立构中心数量:0
15.共价键单元数量:1
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