3,5-Dibromobenzaldehyde - CAS 56990-02-4
Catalog: |
BB029557 |
Product Name: |
3,5-Dibromobenzaldehyde |
CAS: |
56990-02-4 |
Synonyms: |
3,5-dibromobenzaldehyde |
IUPAC Name: | 3,5-dibromobenzaldehyde |
Description: | 3,5-Dibromobenzaldehyde (CAS# 56990-02-4) is a dibrominated benzaldehyde that is a very useful building block for the preparation of a wide range of biologically active compounds such as a antibacterials. |
Molecular Weight: | 263.91 |
Molecular Formula: | C7H4Br2O |
Canonical SMILES: | C1=C(C=C(C=C1Br)Br)C=O |
InChI: | InChI=1S/C7H4Br2O/c8-6-1-5(4-10)2-7(9)3-6/h1-4H |
InChI Key: | ZLDMZIXUGCGKMB-UHFFFAOYSA-N |
Boiling Point: | 287.221 °C at 760 mmHg |
Melting Point: | 84-88 °C |
Purity: | > 97.0 % (GC) |
Density: | 1.977 g/cm3 |
Appearance: | White powder |
MDL: | MFCD00156887 |
LogP: | 3.02410 |
GHS Hazard Statement: | H314 (86.36%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P280, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P332+P313, P337+P313, P362, P363, P405, and P501 |
Signal Word: | Danger |
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Complexity: | 117 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 263.86084 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 261.86289 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 17.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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