| CAS Number | 39995-42-1 |
| Catalog Number | AG00CMH1(AGN-PC-0WCSF6) |
| Chemical Name | 1-Bromo-3-(2-ethoxyethoxy)benzene |
| IUPAC Name | 1-bromo-3-(2-ethoxyethoxy)benzene |
| InChI | InChI=1S/C10H13BrO2/c1-2-12-6-7-13-10-5-3-4-9(11)8-10/h3-5,8H,2,6-7H2,1H3 |
| InChI Key | FNSGRVBRWKODOK-UHFFFAOYSA-N |
| MDL Number | MFCD12173548 |
| Molecular Formula | C10H13BrO2 |
| Molecular Weight | 245.1130 |
| SMILES | C1(Br)C=CC=C(OCCOCC)C=1 |
| Synonyms | 1-bromo-3-(2-ethoxyethoxy)benzene,
39995-42-1,
SCHEMBL7931071,
FNSGRVBRWKODOK-UHFFFAOYSA-N,
MFCD12173548,
ZINC34361461,
AKOS008948139,
AM87958,
|
| Complexity | 130 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 244.01g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 245.116g/mol |
| Monoisotopic Mass | 244.01g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number