Cas no 878427-67-9 (Ethyl 1-(2-phenylethyl)-1H-1,2,3-benzotriazole-5-carboxylate)
Ethyl 1-(2-phenylethyl)-1H-1,2,3-benzotriazole-5-carboxylate is a benzotriazole derivative with potential applications in organic synthesis and pharmaceutical research. Its structure features a phenylethyl-substituted benzotriazole core coupled with an ethyl carboxylate group, offering versatility as an intermediate for further functionalization. The compound’s aromatic and heterocyclic components contribute to its stability and reactivity, making it suitable for use in coupling reactions or as a scaffold for bioactive molecule development. Its ester functionality allows for straightforward derivatization, while the benzotriazole moiety may impart UV-absorbing or metal-chelating properties. This compound is typically handled under standard laboratory conditions, with purity and structural integrity verified by analytical techniques such as NMR and HPLC.
878427-67-9 structure
Product Name:Ethyl 1-(2-phenylethyl)-1H-1,2,3-benzotriazole-5-carboxylate
CAS No:878427-67-9
MF:C17H17N3O2
MW:295.335783720016
MDL:MFCD06654840
CID:3082115
PubChem ID:4913004
Update Time:2025-10-07
Ethyl 1-(2-phenylethyl)-1H-1,2,3-benzotriazole-5-carboxylate Chemical and Physical Properties
Names and Identifiers
-
- 1-Phenethyl-1H-benzotriazole-5-carboxylic acid ethyl ester
- ethyl 1-(2-phenylethyl)benzotriazole-5-carboxylate
- 878427-67-9
- Ethyl 1-phenethyl-1H-benzo[d][1,2,3]triazole-5-carboxylate
- CS-0313391
- NDDFIJMZSWXDDD-UHFFFAOYSA-N
- H34589
- ALBB-024467
- ethyl 1-(2-phenylethyl)-1H-benzotriazole-5-carboxylate
- HMS1700G08
- Ethyl 1-(2-phenylethyl)-1H-1,2,3-benzotriazole-5-carboxylate
- MFCD06654840
- STK735200
- 1H-1,2,3-Benzotriazole-5-carboxylic acid, 1-(2-phenylethyl)-, ethyl ester
- LS-08005
- Ethyl1-phenethyl-1H-benzo[d][1,2,3]triazole-5-carboxylate
- AKOS000643915
-
- MDL： MFCD06654840
- Inchi： 1S/C17H17N3O2/c1-2-22-17(21)14-8-9-16-15(12-14)18-19-20(16)11-10-13-6-4-3-5-7-13/h3-9,12H,2,10-11H2,1H3
- InChI Key： NDDFIJMZSWXDDD-UHFFFAOYSA-N
- SMILES： O(CC)C(C1C=CC2=C(C=1)N=NN2CCC1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 295.132076794Da
- Monoisotopic Mass: 295.132076794Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 22
- Rotatable Bond Count: 6
- Complexity: 371
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.2
- Topological Polar Surface Area: 57?2
Ethyl 1-(2-phenylethyl)-1H-1,2,3-benzotriazole-5-carboxylate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Chemenu | CM527164-1g |
Ethyl 1-phenethyl-1H-benzo[d][1,2,3]triazole-5-carboxylate |
878427-67-9 | 97% | 1g |
$*** | 2023-05-29 | |
| Chemenu | CM527164-5g |
Ethyl 1-phenethyl-1H-benzo[d][1,2,3]triazole-5-carboxylate |
878427-67-9 | 97% | 5g |
$*** | 2023-05-29 | |
| abcr | AB414814-500 mg |
Ethyl 1-(2-phenylethyl)-1H-1,2,3-benzotriazole-5-carboxylate |
878427-67-9 | 500MG |
€165.80 | 2023-02-19 | ||
| abcr | AB414814-1 g |
Ethyl 1-(2-phenylethyl)-1H-1,2,3-benzotriazole-5-carboxylate |
878427-67-9 | 1 g |
€197.30 | 2023-07-19 | ||
| TRC | E130545-500mg |
Ethyl 1-(2-phenylethyl)-1H-1,2,3-benzotriazole-5-carboxylate |
878427-67-9 | 500mg |
$ 195.00 | 2022-06-05 | ||
| TRC | E130545-1000mg |
Ethyl 1-(2-phenylethyl)-1H-1,2,3-benzotriazole-5-carboxylate |
878427-67-9 | 1g |
$ 315.00 | 2022-06-05 | ||
| TRC | E130545-2000mg |
Ethyl 1-(2-phenylethyl)-1H-1,2,3-benzotriazole-5-carboxylate |
878427-67-9 | 2g |
$ 505.00 | 2022-06-05 | ||
| abcr | AB414814-500mg |
Ethyl 1-(2-phenylethyl)-1H-1,2,3-benzotriazole-5-carboxylate; . |
878427-67-9 | 500mg |
€173.00 | 2025-04-15 | ||
| abcr | AB414814-1g |
Ethyl 1-(2-phenylethyl)-1H-1,2,3-benzotriazole-5-carboxylate; . |
878427-67-9 | 1g |
€197.00 | 2025-04-15 | ||
| A2B Chem LLC | BA35659-500mg |
Ethyl 1-(2-phenylethyl)-1h-1,2,3-benzotriazole-5-carboxylate |
878427-67-9 | >95% | 500mg |
$384.00 | 2024-04-19 |
Ethyl 1-(2-phenylethyl)-1H-1,2,3-benzotriazole-5-carboxylate Related Literature
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1. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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