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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)-

Benzoic acid, 4-[(butoxycarbonyl)oxy]-

CCCCOC(=O)Oc1ccc(cc1)C(=O)O Request for Quotation
Chemical Name: Benzoic acid, 4-[(butoxycarbonyl)oxy]-
CAS Number: 14180-12-2
Product Number: AG001H7O(AGN-PC-0JTC9L)
Synonyms:
MDL No:
Molecular Formula: C12H14O5
Molecular Weight: 238.2366

Identification/Properties

Properties
MP:
140 °C
BP:
382.9°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
238.239g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
7
Exact Mass:
238.084g/mol
Monoisotopic Mass:
238.084g/mol
Topological Polar Surface Area:
72.8A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
256
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:
Warning
UN#:
-
Hazard Statements:
H302+H312+H332
Precautionary Statements:
P261-P264-P270-P271-P280-P301+P312+P330-P302+P352+P312+P362+P364-P304+P340+P312-P501
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


4-((Butoxycarbonyl)oxy)benzoic acid, also known as Boc-OH, is a versatile compound widely used in chemical synthesis due to its unique properties and reactivity. In organic chemistry, it serves as a valuable building block for the synthesis of various pharmaceuticals, agrochemicals, and functional materials.One of the key applications of 4-((Butoxycarbonyl)oxy)benzoic acid is as a protecting group in peptide synthesis. The Boc group can be easily attached to the amino group of an amino acid to prevent unwanted side reactions during peptide bond formation. This allows for selective and controlled deprotection at specific stages of the synthesis process, enabling the sequential assembly of complex peptide structures.Furthermore, 4-((Butoxycarbonyl)oxy)benzoic acid is also used in the synthesis of esters and amides. By utilizing its carboxylic acid group, this compound can participate in various coupling reactions to form ester linkages with alcohols or amide linkages with amines. This versatility makes it a valuable tool for the production of a wide range of organic compounds with diverse functionalities.Overall, the application of 4-((Butoxycarbonyl)oxy)benzoic acid in chemical synthesis showcases its importance as a versatile reagent for the preparation of complex molecules with precision and efficiency. Its role in protecting group chemistry and bond-forming reactions highlights its significance in the field of organic synthesis.