942069-59-2
3-CHLORO-N,N-DIMETHYL-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)ANILINE
Name3-CHLORO-N,N-DIMETHYL-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)ANILINE
pro_formulaC14 H21 B Cl N O2
1Identification
【Name】
3-CHLORO-N,N-DIMETHYL-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)ANILINE
【CAS】
【MDL】
MFCD12405331
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C14 H21 B Cl N O2
【pro_molWeight】
281.589
【Inchi】
InChI=1S/C14H21BClNO2/c1-13(2)14(3,4)19-15(18-13)10-7-11(16)9-12(8-10)17(5)6/h7-9H,1-6H3
【InChIKey】
InChIKey=KHZXFJRBVGCQMA-UHFFFAOYSA-N
【SMILES】
B1(OC(C(O1)(C)C)(C)C)c2cc(cc(c2)Cl)N(C)C
【MOL File】
3-CHLORO-N,N-DIMETHY….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:3
XLogP3:3.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
3-CHLORO-N,N-DIMETHYL-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)ANILINE.cml