4-Amino-3,5,6-trichloropyridine-2-carboxylic acid;2-(2,4-dichlorophenoxy)acetic acid
Basic information
- CAS
101239-75-2- Standard SMILES
Nc1c(Cl)c(Cl)nc(C(=O)O)c1Cl.O=C(O)COc1ccc(Cl)cc1Cl- InChIKey
GZKKKPGIVMAHQK-UHFFFAOYSA-N- Molecular formula
- C14H9Cl5N2O5
- Average molar mass
- 462.5 g/mol
- Monoisotopic mass
- 459.89541
Names & identifiers
- Preferred name
- 4-Amino-3,5,6-trichloropyridine-2-carboxylic acid;2-(2,4-dichlorophenoxy)acetic acid
- IUPAC
- 4-amino-3,5,6-trichloropyridine-2-carboxylic acid;2-(2,4-dichlorophenoxy)acetic acid
- English name
- sangor
- Molecular formula
- C14H9Cl5N2O5
- Molecular weight
- 462.49666
Names & synonyms
101239-75-2GZKKKPGIVMAHQK-UHFFFAOYSA-NSCHEMBL5635724DTXSID50276157(2,4-Dichlorophenoxy)acetic acid--4-amino-3,5,6-trichloropyridine-2-carboxylic acid (1/1)4-Amino-3,5,6-trichloropyridine-2-carboxylic acid--(2,4-dichlorophenoxy)acetic acid (1/1)sangor
Database identifiers
- CAS
101239-75-2、37339-60-9- PubChem CID
- 115353
- DTXSID
DTXSID50276157
Properties
Computed structural properties
- Topological polar surface area
- 123 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 402
Physicochemical properties
- EWG's Food Scores
- 1 · 1
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Related reactions
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Compound notes
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