4-Bromo-2-(dimethylamino)benzaldehyde - CAS 1030863-12-7
Catalog: |
BB072249 |
Product Name: |
4-Bromo-2-(dimethylamino)benzaldehyde |
CAS: |
1030863-12-7 |
Synonyms: |
4-Bromo-2-(dimethylamino)benzaldehyde; 4-bromo-2-dimethylaminobenzaldehyde |
IUPAC Name: | 4-bromo-2-(dimethylamino)benzaldehyde |
Molecular Weight: | 228.09 |
Molecular Formula: | C9H10BrNO |
Canonical SMILES: | CN(C)C1=C(C=CC(=C1)Br)C=O |
InChI: | InChI=1S/C9H10BrNO/c1-11(2)9-5-8(10)4-3-7(9)6-12/h3-6H,1-2H3 |
InChI Key: | ZHCFWLVUTGYLRF-UHFFFAOYSA-N |
Complexity: | 161 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 226.99458 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 226.99458 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 20.3Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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