Name: Name:4-Isoxazolecarboxylic acid, 5-(4-broMophenyl)-3-Methyl-, Methyl ester
Brand: Angene
SKU: AG009C8F
Rating: 90 (10 reviews)

4-Isoxazolecarboxylic acid, 5-(4-broMophenyl)-3-Methyl-, Methyl ester

CAS No.:

1228689-61-9

Catalog Number:

AG009C8F

Molecular Formula:

C12H10BrNO3

Molecular Weight:

296.1167

Catalog Number:

AG009C8F

Chemical Name:

4-Isoxazolecarboxylic acid, 5-(4-broMophenyl)-3-Methyl-, Methyl ester

CAS Number:

1228689-61-9

Molecular Formula:

C12H10BrNO3

Molecular Weight:

296.1167

MDL Number:

MFCD18384841

IUPAC Name:

methyl 5-(4-bromophenyl)-3-methyl-1,2-oxazole-4-carboxylate

InChI:

InChI=1S/C12H10BrNO3/c1-7-10(12(15)16-2)11(17-14-7)8-3-5-9(13)6-4-8/h3-6H,1-2H3

InChI Key:

YVWJQDKQALEQHO-UHFFFAOYSA-N

SMILES:

COC(=O)c1c(C)noc1c1ccc(cc1)Br

Complexity:

279

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

294.984g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

296.12g/mol

Monoisotopic Mass:

294.984g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

52.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3: