2-Amino-5-chloro-3-methylbenzoic Acid - CAS 20776-67-4
Catalog: |
BB016284 |
Product Name: |
2-Amino-5-chloro-3-methylbenzoic Acid |
CAS: |
20776-67-4 |
Synonyms: |
2-amino-5-chloro-3-methylbenzoic acid; 2-amino-5-chloro-3-methylbenzoic acid |
IUPAC Name: | 2-amino-5-chloro-3-methylbenzoic acid |
Description: | 2-Amino-5-chloro-3-methylbenzoic Acid (CAS# 20776-67-4) is a useful research chemical for the preparation of benzoyl urea containing anthranillic acid groups with insecticidal activity. |
Molecular Weight: | 185.61 |
Molecular Formula: | C8H8ClNO2 |
Canonical SMILES: | CC1=C(C(=CC(=C1)Cl)C(=O)O)N |
InChI: | InChI=1S/C8H8ClNO2/c1-4-2-5(9)3-6(7(4)10)8(11)12/h2-3H,10H2,1H3,(H,11,12) |
InChI Key: | KOPXCQUAFDWYOE-UHFFFAOYSA-N |
Boiling Point: | 348.357 °C at 760 mmHg |
Density: | 1.401 g/cm3 |
MDL: | MFCD02358895 |
LogP: | 2.51000 |
GHS Hazard Statement: | H317 (30.71%): May cause an allergic skin reaction [Warning Sensitization, Skin] |
Precautionary Statement: | P261, P272, P273, P280, P302+P352, P321, P333+P313, P363, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113501811-A | Chiral thermal activation delayed fluorescent material based on aromatic imide and preparation method and application thereof | 20210716 |
CN-112778147-A | Preparation method of 2-amino-3-methyl-5-chlorobenzoic acid | 20201230 |
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PMID | Publication Date | Title | Journal |
22483270 | 20120407 | Synthesis and antibacterial activity against ralstonia solanacearum for novel hydrazone derivatives containing a pyridine moiety | Chemistry Central journal |
Complexity: | 186 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 185.0243562 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 185.0243562 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 63.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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