2-(5-Imino-3-(trifluoromethyl)-2,5-dihydro-1H-1,2,4-triazol-1-yl)acetic acid hydrochloride

Name: 2-(5-Imino-3-(trifluoromethyl)-2,5-dihydro-1H-1,2,4-triazol-1-yl)acetic acid hydrochloride
Brand: ChemScene
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CAS No. 1185297-12-4
Cat. No. CS-0364705
Molecule weight246.57
Purity≥97%
MDL No.None

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2-(5-Imino-3-(trifluoromethyl)-2,5-dihydro-1H-1,2,4-triazol-1-yl)acetic acid hydrochloride|CS-0364705

Structure of 1185297-12-4

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General Information

CAS No. 1185297-12-4
Cat. No. CS-0364705
Purity ≥97%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₅H₆ClF₃N₄O₂
Molecular Weight 246.57
Synonym(s) (5-AMINO-3-TRIFLUOROMETHYL-[1,2,4]TRIAZOL-1-YL)-ACETIC ACID HYDROCHLORIDE
SMILES C(C(=O)O)N1C(=N)N=C(C(F)(F)F)N1.Cl

Safety Information

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GHS Pictogram : N/A	GHS No : N/A
Signal Word : N/A	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

TPSA 94.76
LogP 0.21587
H_Acceptors 4
H_Donors 3
Rotatable_Bonds 2

Other Classifications

Building Blocks Functional Group Carboxylic Acid

Building Blocks Skeleton Aromatic heterocycle compounds Triazole compounds

Key Words

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2-(5-Imino-3-(trifluoromethyl)-2,5-dihydro-1H-1,2,4-triazol-1-yl)acetic acid hydrochloride

CAS No. 1185297-12-4

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