| CAS Number | 35849-09-3 |
| Catalog Number | AG00C73T(AGN-PC-0NGOR1) |
| Chemical Name | 2-Bromobenzaldehyde Dimethyl Acetal |
| IUPAC Name | 1-bromo-2-(dimethoxymethyl)benzene |
| InChI | InChI=1S/C9H11BrO2/c1-11-9(12-2)7-5-3-4-6-8(7)10/h3-6,9H,1-2H3 |
| InChI Key | RXYLXDKWPRPXMI-UHFFFAOYSA-N |
| MDL Number | MFCD07780683 |
| Molecular Formula | C9H11BrO2 |
| Molecular Weight | 231.0864 |
| SMILES | COC(c1ccccc1Br)OC |
| Synonyms | 2-Bromobenzaldehyde dimethyl acetal,
1-bromo-2-(dimethoxymethyl)benzene,
35849-09-3,
PubChem5376,
SCHEMBL6325,
1-bromo-dimethoxymethyl benzene,
CTK6J3251,
2-bromobenzaldehyde dimethylacetal,
DTXSID10456953,
RXYLXDKWPRPXMI-UHFFFAOYSA-N,
2-Bromo-1-(dimethoxymethyl)benzene,
ZINC28278223,
AKOS024228515,
AS03780,
FCH1385609,
ACM35849093,
BC002962,
ACN-044171,
CID11148943,
|
| Complexity | 126 |
| 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 | 3 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number