N,N-dimethyl-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-thiazol-2-amine

• ChemBase ID: 804199
• Molecular Formular: C11H19BN2O2S
• Molecular Mass: 254.15676
• Monoisotopic Mass: 254.12602926
• SMILES: CC1(C)OB(OC1(C)C)c1nc(sc1)N(C)C
• Canonical SMILES: CN(c1scc(n1)B1OC(C(O1)(C)C)(C)C)C
• InChI: InChI=1S/C11H19BN2O2S/c1-10(2)11(3,4)16-12(15-10)8-7-17-9(13-8)14(5)6/h7H,1-6H3
• InChIKey: UUWOUAFFIVLGHY-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N,N-dimethyl-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-thiazol-2-amine
• IUPAC Traditional name: N,N-dimethyl-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-thiazol-2-amine
• Synonyms: 2-(DIMETHYLAMINO)THIAZOLE-4-BORONIC ACID PINACOL ESTER

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 0
• LogD (pH = 5.5): 4.1230407
• LogD (pH = 7.4): 4.123198
• Log P: 4.1232
• Molar Refractivity: 65.1369 cm^3
• Polarizability: 26.623058 Å^3
• Polar Surface Area: 34.59 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 98%