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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)benzoic acid

OC(=O)c1ccc(cc1)c1noc(n1)C1CC1 Request for Quotation
Chemical Name: 4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)benzoic acid
CAS Number: 915920-27-3
Product Number: AG006GLH(AGN-PC-050H7Z)
Synonyms:
MDL No: MFCD08691678
Molecular Formula: C12H10N2O3
Molecular Weight: 230.2194

Identification/Properties

Properties
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
230.223g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
230.069g/mol
Monoisotopic Mass:
230.069g/mol
Topological Polar Surface Area:
76.2A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
298
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information

GHS Pictogram:
Signal Word:
Danger
UN#:
2811
Hazard Statements:
H301
Precautionary Statements:
P264-P270-P301+P310+P330-P405-P501
Class:
6.1
Packing Group:
Ⅲ

NMR Spectrum

Other Analytical Data

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Chemical Structure


The 4-(5-Cyclopropyl-1,2,4-oxadiazol-3-yl)benzoic acid is a versatile compound that finds wide applications in chemical synthesis. It serves as a key building block in the creation of novel organic molecules with diverse functionalities and properties. In particular, this compound is commonly used as a precursor in the synthesis of heterocyclic compounds, pharmaceutical agents, agrochemicals, and materials science. Its unique structural features make it an important intermediate in the development of various biologically active compounds and advanced materials. Additionally, its reactivity and compatibility with different synthetic routes make it a valuable tool for organic chemists seeking to design and create new molecules with tailored properties.