2-Bromo-6-chlorobenzaldehyde - CAS 64622-16-8
Catalog: |
BB032520 |
Product Name: |
2-Bromo-6-chlorobenzaldehyde |
CAS: |
64622-16-8 |
Synonyms: |
2-bromo-6-chlorobenzaldehyde; 2-bromo-6-chlorobenzaldehyde |
IUPAC Name: | 2-bromo-6-chlorobenzaldehyde |
Description: | 2-Bromo-6-chlorobenzaldehyde (CAS# 64622-16-8) is a useful research chemical. |
Molecular Weight: | 219.46 |
Molecular Formula: | C7H4BrClO |
Canonical SMILES: | C1=CC(=C(C(=C1)Br)C=O)Cl |
InChI: | InChI=1S/C7H4BrClO/c8-6-2-1-3-7(9)5(6)4-10/h1-4H |
InChI Key: | NUGMENVSVAURGO-UHFFFAOYSA-N |
Boiling Point: | 258.819 °C at 760 mmHg |
Density: | 1.698 g/cm3 |
LogP: | 2.91500 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113087700-A | Spirocyclic tetrahydroquinazolines | 20200108 |
US-2021230174-A1 | Spirocyclic tetrahydroquinazolines | 20200108 |
WO-2021139748-A1 | Spirocyclic tetrahydroquinazolines | 20200108 |
WO-2021041671-A1 | Kras g12d inhibitors | 20190829 |
WO-2021028512-A1 | Arylsulfonamide derivatives as mglur4 negative allosteric modulators | 20190815 |
Complexity: | 129 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 217.91341 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 217.91341 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 17.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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