| CAS Number | 938294-99-6 |
| Catalog Number | AG00601Q(AGN-PC-0WNRNE) |
| Chemical Name | 3-Bromo-4-[2-(dimethylamino)ethoxy]benzaldehyde |
| IUPAC Name | 3-bromo-4-[2-(dimethylamino)ethoxy]benzaldehyde |
| InChI | InChI=1S/C11H14BrNO2/c1-13(2)5-6-15-11-4-3-9(8-14)7-10(11)12/h3-4,7-8H,5-6H2,1-2H3 |
| InChI Key | YAEDJYVFADMUPY-UHFFFAOYSA-N |
| MDL Number | MFCD09715088 |
| Molecular Formula | C11H14BrNO2 |
| Molecular Weight | 272.1384 |
| SMILES | O=Cc1ccc(c(c1)Br)OCCN(C)C |
| Synonyms | 938294-99-6,
3-Bromo-4-[2-(dimethylamino)ethoxy]benzaldehyde,
3-Bromo-4-(2-(dimethylamino)ethoxy)benzaldehyde,
ACMC-209rnq,
SCHEMBL15708974,
CTK8B2720,
DTXSID70627561,
YAEDJYVFADMUPY-UHFFFAOYSA-N,
ANW-40116,
MFCD09715088,
ZINC11947462,
AJ-60570,
AX8283937,
TC-128861,
V9323,
B-9096,
3-Bromo-4-[2-(dimethylamino)ethoxy]benzaldehyde, AldrichCPR,
C11H14BrNO2,
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| Complexity | 199 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 271.021g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 272.142g/mol |
| Monoisotopic Mass | 271.021g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number