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162848-16-0

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162848-16-0 Structure

162848-16-0 Structure
IdentificationBack Directory
[Name]

4-(1H-1,2,4-TRIAZOL-1-YL)BENZOIC ACID
[CAS]

162848-16-0
[Synonyms]

AKOS B022049
BUTTPARK 95\50-80
ART-CHEM-BB B022049
RARECHEM AL BE 1325
OTAVA-BB BB7018780039
4-[1,2,4]TRIAZOL-1-YL-BENZOIC ACID
4-(1H-1,2,4-TRIAZOL-1-YL)BENZOIC ACID
4-[1,2,4]TRIAZOL-1-YL-BENZOIC ACID 95%
Benzoic acid, 4-(1H-1,2,4-triazol-1-yl)-
[Molecular Formula]

C9H7N3O2
[MDL Number]

MFCD02682060
[MOL File]

162848-16-0.mol
[Molecular Weight]

189.17
Chemical PropertiesBack Directory
[Melting point ]

318 °C
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

solid
[color ]

Off-white
[InChI]

InChI=1S/C9H7N3O2/c13-9(14)7-1-3-8(4-2-7)12-6-10-5-11-12/h1-6H,(H,13,14)
[InChIKey]

FOMQQGKCPYKKHQ-UHFFFAOYSA-N
[SMILES]

C(O)(=O)C1=CC=C(N2C=NC=N2)C=C1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

36
[Hazard Note ]

Irritant
[HS Code ]

2916399090
Hazard InformationBack Directory
[Uses]

4-(1H-1,2,4-TRIAZOL-1-YL)BENZOIC ACID is used as a ligand in the synthesis of MOF materials.
Spectrum DetailBack Directory
[Spectrum Detail]

4-(1H-1,2,4-TRIAZOL-1-YL)BENZOIC ACID(162848-16-0)1HNMR
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