Cas no 918529-92-7 (1H-Indole-1-carboxylic acid, 3,5-dibromo-, methyl ester)
918529-92-7 structure
Product Name:1H-Indole-1-carboxylic acid, 3,5-dibromo-, methyl ester
CAS No:918529-92-7
MF:C10H7Br2NO2
MW:332.976081132889
CID:773674
PubChem ID:11994314
Update Time:2025-04-19
1H-Indole-1-carboxylic acid, 3,5-dibromo-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indole-1-carboxylic acid, 3,5-dibromo-, methyl ester
- methyl 3,5-dibromoindole-1-carboxylate
- DTXSID20475433
- 918529-92-7
-
- Inchi： 1S/C10H7Br2NO2/c1-15-10(14)13-5-8(12)7-4-6(11)2-3-9(7)13/h2-5H,1H3
- InChI Key： VDIVVTRPDGYQSA-UHFFFAOYSA-N
- SMILES： BrC1=CN(C(=O)OC)C2C=CC(=CC=21)Br
Computed Properties
- Exact Mass: 332.88230g/mol
- Monoisotopic Mass: 330.88435g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 262
- 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: 3.7
- Topological Polar Surface Area: 31.2?2
1H-Indole-1-carboxylic acid, 3,5-dibromo-, methyl ester Related Literature
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Zhizhen Lai,Mo Zhang,Jinyu Zhou,Tianjing Chen,Dan Li,Xuejing Shen,Jia Liu,Jiang Zhou,Zhili Li Analyst, 2021,146, 4261-4267
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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