Cas no 116586-57-3 (1H-Indole-2-carboxylic acid, 2,3-dihydro-, 1,1-dimethylethyl ester, (2S)-)
116586-57-3 structure
Product Name:1H-Indole-2-carboxylic acid, 2,3-dihydro-, 1,1-dimethylethyl ester, (2S)-
CAS No:116586-57-3
MF:C13H17NO2
MW:219.279583692551
CID:5826487
PubChem ID:18632201
Update Time:2024-01-16
1H-Indole-2-carboxylic acid, 2,3-dihydro-, 1,1-dimethylethyl ester, (2S)- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indole-2-carboxylic acid, 2,3-dihydro-, 1,1-dimethylethyl ester, (2S)-
- Tert-butyl (S)-indoline-2-carboxylate
- SCHEMBL7294748
- t-butyl indoline-2(S)-carboxylate
- tert-butyl (2S)-2,3-dihydro-1H-indole-2-carboxylate
- EN300-6508151
- CS-0287490
- 116586-57-3
- BWLRZKYMVHFPLH-NSHDSACASA-N
-
- Inchi： 1S/C13H17NO2/c1-13(2,3)16-12(15)11-8-9-6-4-5-7-10(9)14-11/h4-7,11,14H,8H2,1-3H3/t11-/m0/s1
- InChI Key： BWLRZKYMVHFPLH-NSHDSACASA-N
- SMILES： N1C2=C(C=CC=C2)C[C@H]1C(OC(C)(C)C)=O
Computed Properties
- Exact Mass: 219.125928785g/mol
- Monoisotopic Mass: 219.125928785g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 270
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.9
- Topological Polar Surface Area: 38.3?2
Experimental Properties
- Density: 1.086±0.06 g/cm3(Predicted)
- Boiling Point: 323.8±21.0 °C(Predicted)
- pka: 3.10±0.40(Predicted)
1H-Indole-2-carboxylic acid, 2,3-dihydro-, 1,1-dimethylethyl ester, (2S)- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1358160-50mg |
Tert-butyl (S)-indoline-2-carboxylate |
116586-57-3 | 98% | 50mg |
￥8715.00 | 2024-08-09 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1358160-100mg |
Tert-butyl (S)-indoline-2-carboxylate |
116586-57-3 | 98% | 100mg |
￥7927.00 | 2024-08-09 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1358160-250mg |
Tert-butyl (S)-indoline-2-carboxylate |
116586-57-3 | 98% | 250mg |
￥8920.00 | 2024-08-09 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1358160-500mg |
Tert-butyl (S)-indoline-2-carboxylate |
116586-57-3 | 98% | 500mg |
￥7992.00 | 2024-08-09 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1358160-1g |
Tert-butyl (S)-indoline-2-carboxylate |
116586-57-3 | 98% | 1g |
￥9003.00 | 2024-08-09 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1358160-2.5g |
Tert-butyl (S)-indoline-2-carboxylate |
116586-57-3 | 98% | 2.5g |
￥16286.00 | 2024-08-09 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1358160-5g |
Tert-butyl (S)-indoline-2-carboxylate |
116586-57-3 | 98% | 5g |
￥28092.00 | 2024-08-09 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1358160-10g |
Tert-butyl (S)-indoline-2-carboxylate |
116586-57-3 | 98% | 10g |
￥35726.00 | 2024-08-09 | |
| Enamine | EN300-6508151-0.05g |
tert-butyl (2S)-2,3-dihydro-1H-indole-2-carboxylate |
116586-57-3 | 0.05g |
$323.0 | 2023-05-29 | ||
| Enamine | EN300-6508151-0.1g |
tert-butyl (2S)-2,3-dihydro-1H-indole-2-carboxylate |
116586-57-3 | 0.1g |
$339.0 | 2023-05-29 |
1H-Indole-2-carboxylic acid, 2,3-dihydro-, 1,1-dimethylethyl ester, (2S)- Related Literature
-
Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
-
Jason Wan Lab Chip, 2020,20, 4528-4538
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
-
Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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