| CAS Number | 39255-20-4 |
| Catalog Number | AG00BY88(AGN-PC-03IUOW) |
| Chemical Name | 1-Bromo-4-(2-ethoxyethoxy)benzene |
| EC Number | 254-383-6 |
| IUPAC Name | 1-bromo-4-(2-ethoxyethoxy)benzene |
| InChI | InChI=1S/C10H13BrO2/c1-2-12-7-8-13-10-5-3-9(11)4-6-10/h3-6H,2,7-8H2,1H3 |
| InChI Key | QACZJJNHOATNHA-UHFFFAOYSA-N |
| MDL Number | MFCD00000096 |
| Molecular Formula | C10H13BrO2 |
| Molecular Weight | 245.1130 |
| SMILES | CCOCCOC1C=CC(Br)=CC=1 |
| Synonyms | 1-Bromo-4-(2-ethoxyethoxy)benzene,
39255-20-4,
SCHEMBL3631389,
CTK4I1197,
QACZJJNHOATNHA-UHFFFAOYSA-N,
ZINC35085889,
1-bromanyl-4-(2-ethoxyethoxy)benzene,
AKOS008948015,
Benzene,1-bromo-4-(2-ethoxyethoxy)-,
VZ21281,
AJ-90674,
DB-019077,
FT-0639539,
255B204,
A824489,
1-(4'-Bromophenoxy)-1-ethoxyethane,
C10H13BrO2,
C10-H13-Br-O2,
1-(4-bromophenoxy)-1-ethoxyethane,
EINECS 254-383-6,
|
| Complexity | 122 |
| 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
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number