4-Chloro-2-iodobenzoic acid - CAS 13421-13-1
Catalog: |
BB007896 |
Product Name: |
4-Chloro-2-iodobenzoic acid |
CAS: |
13421-13-1 |
Synonyms: |
4-chloro-2-iodobenzoic acid |
IUPAC Name: | 4-chloro-2-iodobenzoic acid |
Description: | 4-Chloro-2-iodobenzoic acid (CAS# 13421-13-1) is a useful research chemical. |
Molecular Weight: | 282.46 |
Molecular Formula: | C7H4ClIO2 |
Canonical SMILES: | C1=CC(=C(C=C1Cl)I)C(=O)O |
InChI: | InChI=1S/C7H4ClIO2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,(H,10,11) |
InChI Key: | LRRDANNSUCQNDU-UHFFFAOYSA-N |
Boiling Point: | 343.8 °C at 760 mmHg |
Melting Point: | 163-167 °C (lit.) |
Purity: | 95 % |
Density: | 2.077 g/cm3 |
Storage: | Keep in dark place, Sealed in dry, Room Temperature |
MDL: | MFCD00060676 |
LogP: | 2.64280 |
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-113321604-A | Preparation method of beta-carotene with high all-trans content | 20210623 |
EP-3854789-A1 | Macrocyclic compounds useful as chitinase inhibitors | 20200122 |
KR-20210061254-A | Compound for organic electronic element, organic electronic element using the same, and an electronic device thereof | 20191119 |
KR-20210061256-A | Compound for organic electronic element, organic electronic element using the same, and an electronic device thereof | 20191119 |
KR-20210061257-A | Compound for organic electronic element, organic electronic element using the same, and an electronic device thereof | 20191119 |
PMID | Publication Date | Title | Journal |
21617770 | 20110101 | New substituted isocoumarins and Dihydroisocoumarins and their cytotoxic activities | Scientia pharmaceutica |
Complexity: | 163 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 281.89445 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 281.89445 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 37.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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