| CAS Number | 153240-85-8 |
| Catalog Number | AG00AE6G(AGN-PC-03H2UO) |
| Chemical Name | 4-BroMo-2-(phenylMethoxy)phenol |
| IUPAC Name | 4-bromo-2-phenylmethoxyphenol |
| InChI | InChI=1S/C13H11BrO2/c14-11-6-7-12(15)13(8-11)16-9-10-4-2-1-3-5-10/h1-8,15H,9H2 |
| InChI Key | FCRCHBBRZJZSHO-UHFFFAOYSA-N |
| MDL Number | MFCD18433365 |
| Molecular Formula | C13H11BrO2 |
| Molecular Weight | 279.1292 |
| SMILES | OC1=CC=C(Br)C=C1OCC2=CC=CC=C2 |
| Synonyms | 2-(benzyloxy)-4-bromophenol,
153240-85-8,
2-Benzyloxy-4-bromophenol,
2-Benzyloxy-4-bromo-phenol,
4-Bromo-2-(phenylmethoxy)phenol,
4-bromo-2-phenylmethoxyphenol,
SCHEMBL3418336,
CTK8E3794,
DTXSID60619273,
FCRCHBBRZJZSHO-UHFFFAOYSA-N,
MFCD18433365,
ZINC77272927,
AKOS025294584,
FCH2804885,
AK173783,
AS-52545,
TX-016296,
CS-0046815,
FT-0662915,
|
| Complexity | 204 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 277.994g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 279.133g/mol |
| Monoisotopic Mass | 277.994g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.7 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H332-H335
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Packing Group
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Precautionary statements
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P280-P305+P351+P338-P310
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UN Code
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Certificate of Analysis
Lot Number