| CAS Number | 904961-08-6 |
| Catalog Number | AG006P5G(AGN-PC-09T10L) |
| Chemical Name | 3-(5-Bromothiazol-2-yloxy)phenol |
| IUPAC Name | 3-[(5-bromo-1,3-thiazol-2-yl)oxy]phenol |
| InChI | InChI=1S/C9H6BrNO2S/c10-8-5-11-9(14-8)13-7-3-1-2-6(12)4-7/h1-5,12H |
| InChI Key | HOOYSVYDGWBXRG-UHFFFAOYSA-N |
| MDL Number | MFCD08752640 |
| Molecular Formula | C9H6BrNO2S |
| Molecular Weight | 272.1184 |
| SMILES | BrC1=CN=C(OC2C=CC=C(C=2)O)S1 |
| Synonyms | 3-(5-BROMOTHIAZOL-2-YLOXY)PHENOL,
904961-08-6,
3-((5-Bromothiazol-2-yl)oxy)phenol,
CTK5G8026,
DTXSID20698847,
MFCD08752640,
ZINC74938050,
AKOS027380135,
PHENOL,3-[(5-BROMO-2-THIAZOLYL)OXY]-,
3-[(5-BROMO-1,3-THIAZOL-2-YL)OXY]PHENOL,
3- phenol,
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| Complexity | 196 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 270.93g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 272.116g/mol |
| Monoisotopic Mass | 270.93g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 70.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number