| CAS Number | 73898-22-3 |
| Catalog Number | AG00399C(AGN-PC-0BHUGR) |
| Chemical Name | 1-(4-Bromo-3-hydroxyphenyl)ethanone |
| IUPAC Name | 1-(4-bromo-3-hydroxyphenyl)ethanone |
| InChI | InChI=1S/C8H7BrO2/c1-5(10)6-2-3-7(9)8(11)4-6/h2-4,11H,1H3 |
| InChI Key | DLSQLGHKHPBHQB-UHFFFAOYSA-N |
| MDL Number | MFCD17169042 |
| Molecular Formula | C8H7BrO2 |
| Molecular Weight | 215.0440 |
| SMILES | BrC1=C(C=C(C=C1)C(C)=O)O |
| Synonyms | 1-(4-Bromo-3-hydroxyphenyl)ethanone,
73898-22-3,
SCHEMBL10034774,
4'-Bromo-3'-hydroxyacetophenone,
DLSQLGHKHPBHQB-UHFFFAOYSA-N,
KS-000002FV,
MFCD17169042,
ZINC70451301,
AKOS021982160,
FCH1357328,
AK144653,
AS-44414,
AJ-117352,
AX8283063,
CS-0060843,
FT-0746701,
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| Complexity | 158 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 213.963g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.046g/mol |
| Monoisotopic Mass | 213.963g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302
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Packing Group
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Precautionary statements
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P280-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number