CAS 179324-87-9

4,6-Metano-1,3,2-benzodioxaborol-2-metanamina, hexahidro-3a,8,8-trimetil-α-(2-metilpropil)-, (αR,3aS,4S,6S,7aR)-, 2,2,2-trifluoroacetato (1:1)

Descrição:

4,6-Metano-1,3,2-benzodioxaborol-2-metanamina, hexahidro-3a,8,8-trimetil-α-(2-metilpropil)-, (αR,3aS,4S,6S,7aR)-, 2,2,2-trifluoroacetato (1:1) é um composto orgânico complexo caracterizado por suas características estruturais únicas, incluindo uma estrutura de benzodioxaborol e múltiplos estereocentros. Este composto exibe quiralidade, o que é significativo para sua potencial atividade biológica e interações. A presença de um grupo trifluoroacetato sugere que pode ter solubilidade e estabilidade aprimoradas em vários solventes. A estrutura hexahidro indica saturação, o que pode influenciar sua reatividade e interação com alvos biológicos. Além disso, os substituintes trimetila e isopropila contribuem para seu volume estérico, afetando potencialmente sua afinidade de ligação em sistemas biológicos. Este composto pode ser de interesse em química medicinal, particularmente no desenvolvimento de fármacos, devido às suas propriedades estruturais únicas e potencial para interações específicas com moléculas biológicas. No entanto, estudos detalhados sobre sua farmacocinética, toxicidade e atividade biológica seriam necessários para entender completamente suas aplicações.

Fórmula: C₁₅H₂₈BNO₂·C₂HF₃O₂

InChI: InChI=1S/C15H28BNO2.C2HF3O2/c1-9(2)6-13(17)16-18-12-8-10-7-11(14(10,3)4)15(12,5)19-16;3-2(4,5)1(6)7/h9-13H,6-8,17H2,1-5H3;(H,6,7)/t10-,11-,12+,13-,15-;/m0./s1

Chave InChI: InChIKey=SRFQKJZNJYTMNI-CDVUYJLHSA-N

SMILES: C[C@]12[C@@]3(C(C)(C)[C@@](C3)(C[C@]1(OB([C@H](CC(C)C)N)O2)[H])[H])[H].C(C(O)=O)(F)(F)F

Sinónimos:

• (1R)-(1S,2S,3R,5S)-Pinanediol-1-ammoniumtrifluoroacetate-3-methyl butane-1-boronate
• (1R)-(S)-Pinanediol 1-Ammonium trifluoroacetate-3-Methylbutane-1-BORONATE
• (1R)-3-methyl-1-[(3aS,4S,6S,7aR)-3a,5,5-trimethylhexahydro-4,6-methano-1,3,2-benzodioxaborol-2-yl]butan-1-amine trifluoroacetate (1:1)
• (1R)-3-methyl-1-[(3aS,4S,6S,7aR)-3a,5,5-trimethythexahydro-4,6-methano-1,3,2-benzodioxa-borol-2-yl]butan-1-amine trifluoroacetate
• (R)-3-Methyl-1-((3As,4S,6S,7Ar)-3A,5,5-Trimethylhexahydro-4,6-Methanobenzo[D][1,3,2]Dioxaborol-2-Yl)Butan-1-Amine 2,2,2-Trifluoroacetate
• (R)-BoroLeu-(+)-Pinanediol-CF3 COOH
• (R)-BoroLeu-(+)-Pinanediol-CF3CO2H
• (R)-BoroLeu-(+)-Pinanediol-CF3COOH
• (aR,3aS,4S,6S,7aR)-Hexahydro-3a,8,8-trimethyl-alpha-(2-methylpropyl)-
• 2,5-diamino-4,6-dihydroxy pyrimidine Hydrochloride
• 4,6-Methano-1,3,2-benzodioxaborole-2-methanamine, hexahydro-3a,5,5-trimethyl-α-(2-methylpropyl)-, (αR,3aS,4S,6S,7aR)-, trifluoroacetate
• 4,6-Methano-1,3,2-benzodioxaborole-2-methanamine, hexahydro-3a,5,5-trimethyl-α-(2-methylpropyl)-, [3aS-[2(S*),3aα,4β,6β,7aα]]-, trifluoroacetate
• 4,6-Methano-1,3,2-benzodioxaborole-2-methanamine, hexahydro-3a,8,8-trimethyl-α-(2-methylpropyl)-, (αR,3aS,4S,6S,7aR)-, 2,2,2-trifluoroacetate (1:1)
• (aR,3aS,4S,6S,7aR)-Hexahydro-3a,8,8-trimethyl-alpha-(2-methylpropyl)-4,6-methano-1,3,2-benzodioxaborole-2-methanamine  2,2,2-trifluoroacetate

4,6-Methano-1,3,2-benzodioxaborole-2-methanamine, hexahydro-3a,8,8-trimethyl-α-(2-methylpropyl)-, (αR,3aS,4S,6S,7aR)-, 2,2,2-trifluoroacetate (1:1)

CAS: 179324-87-9

Fórmula: C₁₇H₂₉BF₃NO₄

Pureza: 97%

Cor e Forma: Solid

Peso molecular: 379.2227

Ref: IN-DA0026XE

(R)-BoroLeu-(+)-Pinanediol-CF3COOH

CAS: 179324-87-9

Pureza: ≥ 97.0%

Cor e Forma: White to off-white crystalline powder

Ref: 7W-GK4971

(R)-Boroleucine-(1S,2S,3R,5S)-(+)-pinanediol ester trifluoroacetate

CAS: 179324-87-9

(R)-Boroleucine-(1S,2S,3R,5S)-(+)-pinanediol ester trifluoroacetate

Fórmula: C₁₅H₂₈BNO₂·CF₃CO₂H

Pureza: 98%

Cor e Forma: white solid

Peso molecular: 379.22g/mol

Ref: 54-PC200351

(R)-BoroLeu-(+)-pinanediol-trifluoroacetate

CAS: 179324-87-9

(R)-BoroLeu-(+)-pinanediol-trifluoroacetate is a complex compound with CAS No. 179324-87-9 and can be used as a reagent, useful intermediate, or fine chemical. It is a versatile building block that can be used in the synthesis of speciality chemicals, research chemicals, and reaction components. This compound has been reported to be a useful scaffold for the synthesis of novel compounds that could have applications in medicine, such as anti-cancer drugs and antibiotics.

Fórmula: C₁₇H₂₉BF₃NO₄

Cor e Forma: White Off-White Powder

Peso molecular: 379.22 g/mol

Ref: 3D-FB36621

(R)-BoroLeu-(+)-Pinanediol trifluoroacetate, Bortezomib Impurity

CAS: 179324-87-9

Pureza: 97%

Peso molecular: 379.214

Ref: 10-F569026

(R)-BoroLeu-(+)-Pinanediol trifluoroacetate

CAS: 179324-87-9

Fórmula: C₁₇H₂₉BF₃NO₄

Pureza: 97%

Cor e Forma: Solid

Peso molecular: 379.23

Ref: 10-F213743

(alphaR)-(1S,2S,3R,5S)-Pinanediol-1-amino-3-methylbutane-1-boronate Trifluoroacetic Acid Salt

Produto Controlado

CAS: 179324-87-9

Applications Bortezomib (B675700) intermediate. A boronic acid dipeptide derivative as proteasome inhibitors.
References Kisselev, A., et al.: Chem. Biol., 8, 739 (2001), Kisselev, A., et al.: J. Biol. Chem., 278, 35869 (2003), Verdoes, M., et al.: Chem. Biol., 13, 1217 (2006),

Fórmula: C₁₅H₂₈BNO₂·C₂HF₃O₂

Cor e Forma: Neat

Peso molecular: 379.22

Ref: TR-P458505

Bortezomib Amino R Isomer (TFA salt)

CAS: 179324-87-9

Fórmula: C₁₅H₂₈BNO₂C₂HF₃O₂

Peso molecular: 265.2 : 114.0

Ref: ST-EA-CP-B34048