| CAS Number | 1028757-83-6 |
| Catalog Number | AG0092F2(AGN-PC-05FS5A) |
| Chemical Name | 2-amino-5-chloro-3-fluorobenzoic acid |
| IUPAC Name | 2-amino-5-chloro-3-fluorobenzoic acid |
| InChI | InChI=1S/C7H5ClFNO2/c8-3-1-4(7(11)12)6(10)5(9)2-3/h1-2H,10H2,(H,11,12) |
| InChI Key | ARIQKGDNEINNLI-UHFFFAOYSA-N |
| MDL Number | MFCD11193641 |
| Molecular Formula | C7H5ClFNO2 |
| Molecular Weight | 189.5715 |
| SMILES | C(=O)(O)c1c(N)c(F)cc(c1)Cl |
| Synonyms | 2-amino-5-chloro-3-fluorobenzoic acid,
1028757-83-6,
2-Amino-5-chloro-3-fluoro-benzoic acid,
SCHEMBL13469240,
ARIQKGDNEINNLI-UHFFFAOYSA-N,
1517AJ,
MFCD11193641,
ZINC20475945,
AKOS009259859,
MCULE-4664478169,
AJ-77800,
AS-41215,
CS-0047219,
Z-6093,
Z1839480461,
C7H5ClFNO2,
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| Complexity | 190 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 188.999g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 189.57g/mol |
| Monoisotopic Mass | 188.999g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 63.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
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UN Code
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Certificate of Analysis
Lot Number