874289-31-3
4-DIETHYLCARBAMOYL-2-FLUOROBENZENEBORONIC ACID
Name4-DIETHYLCARBAMOYL-2-FLUOROBENZENEBORONIC ACID
1Identification
【Name】
4-DIETHYLCARBAMOYL-2-FLUOROBENZENEBORONIC ACID
【CAS】
【MDL】
MFCD16036546
【English Synonyms】
【Formula】
C11 H15 B F N O3
【MolWeight】
239.053
【Inchi】
InChI=1S/C11H15BFNO3/c1-3-14(4-2)11(15)8-5-6-9(12(16)17)10(13)7-8/h5-7,16-17H,3-4H2,1-2H3
【InChIKey】
InChIKey=DNLSLUZRDMSBDI-UHFFFAOYSA-N
【SMILES】
B(c1ccc(cc1F)C(=O)N(CC)CC)(O)O
【MOL File】
4-DIETHYLCARBAMOYL-2….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-DIETHYLCARBAMOYL-2-FLUOROBENZENEBORONIC ACID.cml