3-(3-吲唑)丙酸
3-(3-吲唑)丙酸结构式
|
常用名 | 3-(3-吲唑)丙酸 | 英文名 | 4-(1H-INDAZOL-3-YL)BUTAN-2-ONE |
|---|---|---|---|---|
| CAS号 | 214541-51-2 | 分子量 | 188.22600 | |
| 密度 | 1.19g/cm3 | 沸点 | 367.2ºC at 760 mmHg | |
| 分子式 | C11H12N2O | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 179.5ºC |
本表展示该化学物质的中文名称、英文系统名、各类中文与英文别名信息。
| 中文名 | 3-(3-吲唑)丙酸 |
|---|---|
| 英文名 | 4-(2H-indazol-3-yl)butan-2-one |
| 英文别名 | 更多 |
本表包含该物质理化参数，如熔点、沸点、密度、溶解度、旋光性等理化指标，无数据项标记为N/A。
| 密度 | 1.19g/cm3 |
|---|---|
| 沸点 | 367.2ºC at 760 mmHg |
| 分子式 | C11H12N2O |
| 分子量 | 188.22600 |
| 闪点 | 179.5ºC |
| 精确质量 | 188.09500 |
| PSA | 45.75000 |
| LogP | 2.08450 |
| InChIKey | CDLAOGKXZIBTLH-UHFFFAOYSA-N |
| SMILES | CC(=O)CCc1[nH]nc2ccccc12 |
| 蒸汽压 | 1.39E-05mmHg at 25°C |
| 折射率 | 1.619 |
本表提供该化合物公开报道的合成路线、反应条件、反应物与产物参考信息。
|
~67%
3-(3-吲唑)丙酸 214541-51-2 |
| 文献：Matsuda, Kazuhiko; Toyoda, Hideyoshi; Nishio, Hitomi; Nishida, Takatsugu; Dohgo, Mitsue; Bingo, Miki; Matsuda, Yoshinori; Yoshida, Satoshi; Harada, Satoshi; Tanaka, Hiroshi; Komai, Koichiro; Ouchi, Seiji Journal of Agricultural and Food Chemistry, 1998 , vol. 46, # 10 p. 4416 - 4419 |
|
~%
3-(3-吲唑)丙酸 214541-51-2 |
| 文献：CONNEXIOS LIFE SCIENCES PVT. LTD.; RAO, Jagannath Madanahalli Ranganath; VENKATESHAM, Uppala; GEORGE, Jenson; FERNAND, George; DOPPALAPUDI, Sivanageswara Rao; MADHAVAN, G R; ARUMUGAM, Nagarajan; ANSARI, Mohammed; MURUGAVEL, K; PRADEEP, Jidugu; ALLAVUDDEEN, Sulthan; VIJAYARAMALINGAM, K; PRASAD, Hampelingaiah Shiva; RAJ, Augustine Michael; GNANAVEL, S; KOTTAMALAI, Ramamoorthy; BABU, Naresh M P S; KENCHEGOWDA, Bommegowda Yadaganahalli Patent: WO2013/128465 A1, 2013 ; Location in patent: Page/Page column 147; 148 ; |
|
~97%
3-(3-吲唑)丙酸 214541-51-2 |
| 文献：Collot, Valerie; Varlet, Didier; Rault, Sylvain Tetrahedron Letters, 2000 , vol. 41, # 22 p. 4363 - 4366 |
|
~%
3-(3-吲唑)丙酸 214541-51-2 |
| 文献：CONNEXIOS LIFE SCIENCES PVT. LTD.; RAO, Jagannath Madanahalli Ranganath; VENKATESHAM, Uppala; GEORGE, Jenson; FERNAND, George; DOPPALAPUDI, Sivanageswara Rao; MADHAVAN, G R; ARUMUGAM, Nagarajan; ANSARI, Mohammed; MURUGAVEL, K; PRADEEP, Jidugu; ALLAVUDDEEN, Sulthan; VIJAYARAMALINGAM, K; PRASAD, Hampelingaiah Shiva; RAJ, Augustine Michael; GNANAVEL, S; KOTTAMALAI, Ramamoorthy; BABU, Naresh M P S; KENCHEGOWDA, Bommegowda Yadaganahalli Patent: WO2013/128465 A1, 2013 ; |
|
~%
3-(3-吲唑)丙酸 214541-51-2 |
| 文献：CONNEXIOS LIFE SCIENCES PVT. LTD.; RAO, Jagannath Madanahalli Ranganath; VENKATESHAM, Uppala; GEORGE, Jenson; FERNAND, George; DOPPALAPUDI, Sivanageswara Rao; MADHAVAN, G R; ARUMUGAM, Nagarajan; ANSARI, Mohammed; MURUGAVEL, K; PRADEEP, Jidugu; ALLAVUDDEEN, Sulthan; VIJAYARAMALINGAM, K; PRASAD, Hampelingaiah Shiva; RAJ, Augustine Michael; GNANAVEL, S; KOTTAMALAI, Ramamoorthy; BABU, Naresh M P S; KENCHEGOWDA, Bommegowda Yadaganahalli Patent: WO2013/128465 A1, 2013 ; |
|
~%
3-(3-吲唑)丙酸 214541-51-2 |
| 文献：CONNEXIOS LIFE SCIENCES PVT. LTD.; RAO, Jagannath Madanahalli Ranganath; VENKATESHAM, Uppala; GEORGE, Jenson; FERNAND, George; DOPPALAPUDI, Sivanageswara Rao; MADHAVAN, G R; ARUMUGAM, Nagarajan; ANSARI, Mohammed; MURUGAVEL, K; PRADEEP, Jidugu; ALLAVUDDEEN, Sulthan; VIJAYARAMALINGAM, K; PRASAD, Hampelingaiah Shiva; RAJ, Augustine Michael; GNANAVEL, S; KOTTAMALAI, Ramamoorthy; BABU, Naresh M P S; KENCHEGOWDA, Bommegowda Yadaganahalli Patent: WO2013/128465 A1, 2013 ; |
|
~%
3-(3-吲唑)丙酸 214541-51-2 |
| 文献：Plexxikon, Inc. Patent: US2005/288354 A1, 2005 ; |
|
~%
3-(3-吲唑)丙酸 214541-51-2 |
| 文献：CONNEXIOS LIFE SCIENCES PVT. LTD.; RAO, Jagannath Madanahalli Ranganath; VENKATESHAM, Uppala; GEORGE, Jenson; FERNAND, George; DOPPALAPUDI, Sivanageswara Rao; MADHAVAN, G R; ARUMUGAM, Nagarajan; ANSARI, Mohammed; MURUGAVEL, K; PRADEEP, Jidugu; ALLAVUDDEEN, Sulthan; VIJAYARAMALINGAM, K; PRASAD, Hampelingaiah Shiva; RAJ, Augustine Michael; GNANAVEL, S; KOTTAMALAI, Ramamoorthy; BABU, Naresh M P S; KENCHEGOWDA, Bommegowda Yadaganahalli Patent: WO2013/128465 A1, 2013 ; |
|
~%
3-(3-吲唑)丙酸 214541-51-2 |
| 文献：Collot, Valerie; Varlet, Didier; Rault, Sylvain Tetrahedron Letters, 2000 , vol. 41, # 22 p. 4363 - 4366 |
![tert-butyl 3-[(1E)-3-ethoxy-3-oxoprop-1-en-1-yl]-1H-indazole-1-carboxylate结构式](https://image.chemsrc.com/caspic/408/290368-05-7.png)
本表罗列该化合物全部英文别名、系统命名、CAS别名等英文名称集合。
| 3-indazol-3-yl-propionic acid |
| 1H-Indazole-3-propionic acid |
| Indazole-3-propionic acid |
| 4-(1H-INDAZOL-3-YL)BUTAN-2-ONE |
| 3-(1H-indazol-3-yl) propanoic acid |
| 3-(3-indazolyl)propionic acid |
| 3-indazolylpropionic acid |
本部分为该化合物相关常见问答，包含基础参数、性状、储存条件等高频咨询问题与对应答案。
| Q: 3-(3-吲唑)丙酸有哪些英文别名？ |
| A: 3-(3-吲唑)丙酸英文别名有：3-indazol-3-yl-propionic acid、 1H-Indazole-3-propionic acid、 Indazole-3-propionic acid、 4-(1H-INDAZOL-3-YL)BUTAN-2-ONE、 3-(1H-indazol-3-yl) propanoic acid、 3-(3-indazolyl)propionic acid、 3-indazolylpropionic acid。 |
| Q: 3-(3-吲唑)丙酸的InChIKey是什么？ |
| A: 3-(3-吲唑)丙酸InChIKey为CDLAOGKXZIBTLH-UHFFFAOYSA-N。 |
| Q: 3-(3-吲唑)丙酸的沸点是多少？ |
| A: 3-(3-吲唑)丙酸沸点为367.2ºC at 760 mmHg。 |
| Q: 3-(3-吲唑)丙酸的分子式是什么？ |
| A: 3-(3-吲唑)丙酸分子式为C11H12N2O。 |
| Q: 3-(3-吲唑)丙酸的英文名称是什么？ |
| A: 3-(3-吲唑)丙酸英文名称为4-(2H-indazol-3-yl)butan-2-one。 |
| Q: 3-(3-吲唑)丙酸的CAS号是多少？ |
| A: 3-(3-吲唑)丙酸CAS号为214541-51-2。 |
| Q: 3-(3-吲唑)丙酸的SMILES表达式是什么？ |
| A: 3-(3-吲唑)丙酸SMILES表达式为CC(=O)CCc1[nH]nc2ccccc12。 |
| Q: 3-(3-吲唑)丙酸的LogP（油水分配系数）是多少？ |
| A: 3-(3-吲唑)丙酸LogP（油水分配系数）为2.08450。 |
| Q: 3-(3-吲唑)丙酸的极性表面积PSA是多少？ |
| A: 3-(3-吲唑)丙酸极性表面积PSA为45.75000。 |
| Q: 214541-51-2的中文名称是什么？ |
| A: 214541-51-2的中文名称为3-(3-吲唑)丙酸。 |
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