| CAS Number | 1099672-01-1 |
| Catalog Number | AG007EEI(AGN-PC-0WAA2N) |
| Chemical Name | 4-Bromo-2-isopropoxybenzaldehyde |
| IUPAC Name | 4-bromo-2-propan-2-yloxybenzaldehyde |
| InChI | InChI=1S/C10H11BrO2/c1-7(2)13-10-5-9(11)4-3-8(10)6-12/h3-7H,1-2H3 |
| InChI Key | KPWKJHWWEJTFPE-UHFFFAOYSA-N |
| MDL Number | MFCD11651784 |
| Molecular Formula | C10H11BrO2 |
| Molecular Weight | 243.0971 |
| SMILES | CC(OC1=C(C=O)C=CC(Br)=C1)C |
| Synonyms | 4-Bromo-2-isopropoxybenzaldehyde,
1099672-01-1,
CTK8A9219,
DTXSID30742668,
ACMC-209951,
ANW-16115,
MFCD11651784,
ZINC37474891,
4-bromo-2-propan-2-yloxybenzaldehyde,
AKOS022186701,
AJ-94012,
4-Bromo-2-[(propan-2-yl)oxy]benzaldehyde,
TC-104860,
Z7298,
4-Bromo-2-isopropoxybenzaldehyde, AldrichCPR,
B-8852,
C10H11BrO2,
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| Complexity | 170 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 241.994g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 243.1g/mol |
| Monoisotopic Mass | 241.994g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number