| CAS Number | 227305-66-0 |
| Catalog Number | AG00I4H2(AGN-PC-0WRAF6) |
| Chemical Name | 1-BROMO-3-(2-METHOXYETHOXY)BENZENE |
| IUPAC Name | 1-bromo-3-(2-methoxyethoxy)benzene |
| InChI | InChI=1S/C9H11BrO2/c1-11-5-6-12-9-4-2-3-8(10)7-9/h2-4,7H,5-6H2,1H3 |
| InChI Key | CFUFZUWSBHTKRQ-UHFFFAOYSA-N |
| MDL Number | MFCD09928066 |
| Molecular Formula | C9H11BrO2 |
| Molecular Weight | 231.0864 |
| SMILES | COCCOC1=CC(Br)=CC=C1 |
| Synonyms | 1-bromo-3-(2-methoxyethoxy)benzene,
227305-66-0,
AC1Q4GBE,
SCHEMBL1820853,
CTK7B3777,
CFUFZUWSBHTKRQ-UHFFFAOYSA-N,
ZINC19423542,
AKOS000167505,
FS-5734,
MCULE-8591228894,
NE29612,
1-Bromo-3-(2-methoxy-ethoxy)-benzene,
EN300-49096,
Z285938612,
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| Complexity | 119 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 229.994g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 231.089g/mol |
| Monoisotopic Mass | 229.994g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
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Certificate of Analysis
Lot Number