5-Chloroisobenzofuran-1,3-dione - CAS 118-45-6
Catalog: |
BB004109 |
Product Name: |
5-Chloroisobenzofuran-1,3-dione |
CAS: |
118-45-6 |
Synonyms: |
5-chloroisobenzofuran-1,3-dione; 5-chloro-2-benzofuran-1,3-dione |
IUPAC Name: | 5-chloro-2-benzofuran-1,3-dione |
Description: | 5-Chloroisobenzofuran-1,3-dione (CAS# 118-45-6) is a useful research chemical. |
Molecular Weight: | 182.56 |
Molecular Formula: | C8H3ClO3 |
Canonical SMILES: | C1=CC2=C(C=C1Cl)C(=O)OC2=O |
InChI: | InChI=1S/C8H3ClO3/c9-4-1-2-5-6(3-4)8(11)12-7(5)10/h1-3H |
InChI Key: | BTTRMCQEPDPCPA-UHFFFAOYSA-N |
Boiling Point: | 299.8 °C at 760 mmHg |
Density: | 1.594 g/cm3 |
Storage: | Inert atmosphere, Room Temperature |
MDL: | MFCD00152354 |
LogP: | 1.65060 |
GHS Hazard Statement: | H315 (57.14%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-113024496-A | Method for preparing 4-p-trifluoromethyl phenyl alkynyl phthalic anhydride | 20210324 |
CN-112961132-A | Method for preparing monochlorophthalic anhydride in micro-channel continuous flow reactor | 20210224 |
CN-112961133-A | Production method of 4-chlorophthalic anhydride | 20210224 |
CN-112851611-A | Preparation method of 4, 4' -diphenyl ether tetracarboxylic dianhydride | 20210128 |
CN-112707879-A | Method for preparing oxo-bis- (N-methylphthalimide) | 20201230 |
PMID | Publication Date | Title | Journal |
17165547 | 20060901 | [Simultaneous determination of monochlorophthalic anhydride and monochlorophthalic acid in substrates by high performance liquid chromatography] | Se pu = Chinese journal of chromatography |
Complexity: | 239 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 181.9770716 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 181.9770716 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 43.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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