4-Bromo-2,6-dimethoxybenzaldehyde - CAS 1354050-38-6
Catalog: |
BB055298 |
Product Name: |
4-Bromo-2,6-dimethoxybenzaldehyde |
CAS: |
1354050-38-6 |
Synonyms: |
4-Bromo-2,6-dimethoxybenzaldehyde; 4-Bromo-2,6-dimethoxy-benzaldehyde; Benzaldehyde, 4-bromo-2,6-dimethoxy- |
IUPAC Name: | 4-bromo-2,6-dimethoxybenzaldehyde |
Molecular Weight: | 245.07 |
Molecular Formula: | C9H9BrO3 |
Canonical SMILES: | COC1=CC(=CC(=C1C=O)OC)Br |
InChI: | InChI=1S/C9H9BrO3/c1-12-8-3-6(10)4-9(13-2)7(8)5-11/h3-5H,1-2H3 |
InChI Key: | HNUALSDMDHKUEH-UHFFFAOYSA-N |
GHS Hazard Statement: | H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
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Complexity: | 160 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 243.97351 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 243.97351 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 35.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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