Cas no 144808-59-3 (3-bromo-5-methoxy-1,2-dimethyl-1H-indole)
144808-59-3 structure
Product Name:3-bromo-5-methoxy-1,2-dimethyl-1H-indole
CAS No:144808-59-3
MF:C11H12BrNO
MW:254.12308216095
CID:2777801
PubChem ID:71345902
Update Time:2025-04-21
3-bromo-5-methoxy-1,2-dimethyl-1H-indole Chemical and Physical Properties
Names and Identifiers
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- DTXSID00772139
- 3-bromo-5-methoxy-1,2-dimethyl-1H-indole
- 144808-59-3
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- Inchi： 1S/C11H12BrNO/c1-7-11(12)9-6-8(14-3)4-5-10(9)13(7)2/h4-6H,1-3H3
- InChI Key： SIYYSBXBZBYFHY-UHFFFAOYSA-N
- SMILES： BrC1=C(C)N(C)C2C=CC(=CC=21)OC
Computed Properties
- Exact Mass: 253.01023g/mol
- Monoisotopic Mass: 253.01023g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 212
- 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: 3.1
- Topological Polar Surface Area: 14.2?2
3-bromo-5-methoxy-1,2-dimethyl-1H-indole 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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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
144808-59-3 (3-bromo-5-methoxy-1,2-dimethyl-1H-indole) Related Products
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