Cas no 116016-64-9 (2-Bromo-3-methyl-5-phenylthiophene)
116016-64-9 structure
Product Name:2-Bromo-3-methyl-5-phenylthiophene
CAS No:116016-64-9
MF:C11H9BrS
MW:253.158160924911
CID:2895644
PubChem ID:14113889
Update Time:2025-04-21
2-Bromo-3-methyl-5-phenylthiophene Chemical and Physical Properties
Names and Identifiers
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- DB-163948
- 116016-64-9
- SCHEMBL20764832
- 2-bromo-3-methyl-5-phenyl-thiophene
- 2-Bromo-3-methyl-5-phenylthiophene
-
- Inchi： 1S/C11H9BrS/c1-8-7-10(13-11(8)12)9-5-3-2-4-6-9/h2-7H,1H3
- InChI Key： WJJWUXAKXFHTQZ-UHFFFAOYSA-N
- SMILES： BrC1=C(C)C=C(C2C=CC=CC=2)S1
Computed Properties
- Exact Mass: 251.96083Da
- Monoisotopic Mass: 251.96083Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 165
- 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: 4.7
- Topological Polar Surface Area: 28.2?2
2-Bromo-3-methyl-5-phenylthiophene Related Literature
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
116016-64-9 (2-Bromo-3-methyl-5-phenylthiophene) Related Products
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