2-Amino-4-iodobenzoic Acid - CAS 20776-54-9
Catalog: |
BB016280 |
Product Name: |
2-Amino-4-iodobenzoic Acid |
CAS: |
20776-54-9 |
Synonyms: |
2-amino-4-iodobenzoic acid; 2-amino-4-iodobenzoic acid |
IUPAC Name: | 2-amino-4-iodobenzoic acid |
Description: | 2-Amino-4-iodobenzoic Acid (CAS# 20776-54-9) is a useful research chemical. |
Molecular Weight: | 263.03 |
Molecular Formula: | C7H6INO2 |
Canonical SMILES: | C1=CC(=C(C=C1I)N)C(=O)O |
InChI: | InChI=1S/C7H6INO2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,9H2,(H,10,11) |
InChI Key: | KWIIUIVETQQQHX-UHFFFAOYSA-N |
Boiling Point: | 377.02 ℃ at 760 mmHg |
Density: | 2.082 g/cm3 |
Appearance: | Solid |
LogP: | 2.15280 |
GHS Hazard Statement: | H302 (33.33%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021202480-A1 | Compounds targeting prmt5 | 20200401 |
CN-112939948-A | Novel quinazoline-containing compound, intermediate and application thereof | 20191211 |
WO-2021115432-A1 | Novel quinazoline-containing compound, and intermediate thereof and use thereof | 20191211 |
CN-111018839-A | Triazole alcohol derivative and preparation method and application thereof | 20191202 |
US-2020317686-A1 | Compounds targeting prmt5 | 20190402 |
Complexity: | 163 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 262.94433 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 262.94433 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 63.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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