CAS
944899-60-9 Purity
96%
944899-60-9 Purity
96%
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5-Amino-2-trifluoromethyl-isonicotinic acid
CAS
944900-27-0
Catalog Number
ACM944900270
Category
Other Products
Molecular Weight
206.122010 [g/mol]
Molecular Formula
C7H5F3N2O2
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Specification
Synonyms
5-AMINO-2-TRIFLUOROMETHYL-ISONICOTINIC ACID, 944900-27-0, CTK5H6711, AB56831, AG-H-90187, KB-244551, 5-AMINO-2-(TRIFLUOROMETHYL)PYRIDINE-4-CARBOXYLIC ACID
IUPAC Name
5-amino-2-(trifluoromethyl)pyridine-4-carboxylic acid
InChI Key
UTORUAWKVSIHOQ-UHFFFAOYSA-N
Exact Mass
206.03000
H-Bond Acceptor
7
H-Bond Donor
2
What is the molecular formula of the compound?
The molecular formula of the compound is C7H5F3N2O2.
What is the molecular weight of the compound?
The molecular weight of the compound is 206.12 g/mol.
What is the IUPAC name of the compound?
The IUPAC name of the compound is 5-amino-2-(trifluoromethyl)pyridine-4-carboxylic acid.
What is the InChI of the compound?
The InChI of the compound is InChI=1S/C7H5F3N2O2/c8-7(9,10)5-1-3(6(13)14)4(11)2-12-5/h1-2H,11H2,(H,13,14).
What is the InChIKey of the compound?
The InChIKey of the compound is UTORUAWKVSIHOQ-UHFFFAOYSA-N.
What is the Canonical SMILES of the compound?
The Canonical SMILES of the compound is C1=C(C(=CN=C1C(F)(F)F)N)C(=O)O.
What is the CAS number of the compound?
The CAS number of the compound is 944900-27-0.
What is the European Community (EC) number of the compound?
The European Community (EC) number of the compound is 861-822-0.
What is the DSSTox Substance ID of the compound?
The DSSTox Substance ID of the compound is DTXSID10697405.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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