Cas no 89167-17-9 (THIOPHENE, 5-(BROMOMETHYL)-2,3-DICHLORO-)
89167-17-9 structure
Product Name:THIOPHENE, 5-(BROMOMETHYL)-2,3-DICHLORO-
CAS No:89167-17-9
MF:C5H3BrCl2S
MW:245.952317476273
CID:3539041
PubChem ID:86247248
Update Time:2025-04-22
THIOPHENE, 5-(BROMOMETHYL)-2,3-DICHLORO- Chemical and Physical Properties
Names and Identifiers
-
- THIOPHENE, 5-(BROMOMETHYL)-2,3-DICHLORO-
- DTXSID501288426
- DB-413179
- 5-(Bromomethyl)-2,3-dichlorothiophene
- 89167-17-9
-
- Inchi： 1S/C5H3BrCl2S/c6-2-3-1-4(7)5(8)9-3/h1H,2H2
- InChI Key： BJRCMVYQHYNDGS-UHFFFAOYSA-N
- SMILES： BrCC1=CC(=C(S1)Cl)Cl
Computed Properties
- Exact Mass: 243.85159Da
- Monoisotopic Mass: 243.85159Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 9
- Rotatable Bond Count: 1
- Complexity: 101
- 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: 3.8
- Topological Polar Surface Area: 28.2?2
THIOPHENE, 5-(BROMOMETHYL)-2,3-DICHLORO- Related Literature
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Chen Long,Ying Dai,Jianwei Li,Hao Jin Nanoscale, 2020,12, 21124-21130
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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