Cas no 41598-79-2 (ETHYL 5-BROMO-2-(BROMOMETHYL)NICOTINATE)
41598-79-2 structure
Product Name:ETHYL 5-BROMO-2-(BROMOMETHYL)NICOTINATE
CAS No:41598-79-2
MF:C9H9Br2NO2
MW:322.981261014938
CID:2116302
Update Time:2023-11-19
ETHYL 5-BROMO-2-(BROMOMETHYL)NICOTINATE Chemical and Physical Properties
Names and Identifiers
-
- ethyl 5-bromo-2-(bromomethyl)nicotinate
- CID 126485404
- 3-Pyridinecarboxylic acid, 5-bromo-2-(bromomethyl)-, ethyl ester
- ETHYL 5-BROMO-2-(BROMOMETHYL)NICOTINATE
-
- Inchi： 1S/C9H9Br2NO2/c1-2-14-9(13)7-3-6(11)5-12-8(7)4-10/h3,5H,2,4H2,1H3
- InChI Key： BIUBFADHNONGGX-UHFFFAOYSA-N
- SMILES： BrCC1C(C(=O)OCC)=CC(=CN=1)Br
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 201
- Topological Polar Surface Area: 39.2
Experimental Properties
- Density: 1.767±0.06 g/cm3(Predicted)
- Boiling Point: 347.8±42.0 °C(Predicted)
- pka: -0.86±0.32(Predicted)
ETHYL 5-BROMO-2-(BROMOMETHYL)NICOTINATE Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1603792-1g |
Ethyl 5-bromo-2-(bromomethyl)nicotinate |
41598-79-2 | 98% | 1g |
￥5614.00 | 2024-05-14 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1603792-5g |
Ethyl 5-bromo-2-(bromomethyl)nicotinate |
41598-79-2 | 98% | 5g |
￥16835.00 | 2024-05-14 |
ETHYL 5-BROMO-2-(BROMOMETHYL)NICOTINATE Related Literature
-
Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
-
Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
-
Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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