4-Bromophthalic Acid - CAS 6968-28-1
Catalog: |
BB033925 |
Product Name: |
4-Bromophthalic Acid |
CAS: |
6968-28-1 |
Synonyms: |
4-bromophthalic acid; 4-bromophthalic acid |
IUPAC Name: | 4-bromophthalic acid |
Description: | 4-Bromophthalic Acid (CAS# 6968-28-1) is a useful research chemical. |
Molecular Weight: | 245.03 |
Molecular Formula: | C8H5BrO4 |
Canonical SMILES: | C1=CC(=C(C=C1Br)C(=O)O)C(=O)O |
InChI: | InChI=1S/C8H5BrO4/c9-4-1-2-5(7(10)11)6(3-4)8(12)13/h1-3H,(H,10,11)(H,12,13) |
InChI Key: | AZXKGUVDIORSED-UHFFFAOYSA-N |
Boiling Point: | 412.4 °C at 760 mmHg |
MDL: | MFCD00043538 |
LogP: | 1.84550 |
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-112387311-A | Ethylene oligomerization catalyst system, preparation method and application thereof | 20201022 |
CN-112473738-A | Ethylene oligomerization catalyst system and preparation method and application thereof | 20201022 |
CN-112473741-A | Ethylene oligomerization catalyst system and preparation method and application thereof | 20201022 |
CN-111925331-A | Synthetic method of 6-bromophthalazine | 20200714 |
WO-2021155321-A2 | Compounds and uses thereof | 20200129 |
Complexity: | 228 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 243.93712 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 243.93712 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 74.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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