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(1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0,2,6]decan-4-yl]butan-1-amine, trifluoroacetic acid | CAS No. 179324-87-9

(1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0,2,6]decan-4-yl]butan-1-amine, trifluoroacetic acid

Basic Information

Chemical_Structure_Of
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CAS Number

179324-87-9

Molecular Formula

C17H29BF3NO4

Molecular Weight

379.23 g/mol

AD

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids
Basic Chemical Raw Materials Organic Chemicals Amines
Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds
Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates
Fine Chemicals Surfactants Anionic Surfactants
Fine Chemicals Specialty Chemicals UV Stabilizers

Basic Physical Properties

SMILES

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B1(OC2CC3CC(C3(C)C)C2(O1)C)C(CC(C)C)N.C(=O)(C(F)(F)F)O

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

InChIKey

SRFQKJZNJYTMNI-CDVUYJLHSA-N

LogP

3.260600000000001

Topological Polar Surface Area

81.78 Ų

Hydrogen Bond Donor/Acceptor

3 / 5

Complexity

457

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral
H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H332 Harmful if inhaled
Acute toxicity, inhalation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

  • 4,6-Methano-1,3,2-benzodioxaborole-2-methanamine, hexahydro-3a,8,8-trimethyl-alpha-(2-methylpropyl)-, (alphaR,3aS,4S,6S,7aR)-, 2,2,2-trifluoroacetate (1:1)
  • Q-102518
  • A846442
  • (1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0?,?]decan-4-yl]butan-1-amine; trifluoroacetic acid
  • (1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0^{2,6}]decan-4-yl]butan-1-amine; trifluoroacetic acid
  • (R)-BOROLEU-(+)-PINANEDIOL TFA
  • CS-W019140
  • (?R)-(1S,2S,3R,5S)-Pinanediol-1-amino-3-methylbutane-1-boronate Trifluoroacetic Acid Salt
  • Z3082065227
  • (R)-BoroLeu-(+)-Pinanedioltrifluoroacetate
  • MFCD10566030
  • (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
  • DTXSID00658025
  • Trifluoroacetic acid--(1R)-3-methyl-1-[(3aS,4S,6S,7aR)-3a,5,5-trimethylhexahydro-2H-4,6-methano-1,3,2-benzodioxaborol-2-yl]butan-1-amine (1/1)
  • AMY4256
  • (R)-BoroLeu-(+)-Pinanediol trifluoroacetate
  • (R)-Boroleucine-(1S,2S,3R,5S)-(+)-pinanediol ester 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-CF3COOH
  • (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-trifluor oacetate
  • (1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0,2,6]decan-4-yl]butan-1-amine; trifluoroacetic acid
  • BS-2025
  • EN300-7390232
  • (1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.02,6]decan-4-yl]butan-1-amine;2,2,2-trifluoroacetic acid
  • (alphaR)-(1S,2S,3R,5S)-Pinanediol-1-amino-3-methylbutane-1-boronate Trifluoroacetic Acid Salt
  • AKOS015896703
  • AC-2355
  • (1R)-(S)-PINANEDIOL-1-AMINO-3-METHYLBUTANE-1-BORONATE, TRIFLUOROACETATE
  • 179324-87-9
  • (1R)-3-METHYL-1-[(1S,2S,6R,8S)-2,9,9-TRIMETHYL-3,5-DIOXA-4-BORATRICYCLO[6.1.1.0(2),?]DECAN-4-YL]BUTAN-1-AMINE; TRIFLUOROACETIC ACID
  • (1R)-(S)-Pinanediol 1-ammonium trifluoroacetate-3-methylbutane-1-boronate

MDL Number

MFCD10566030

Customs Code

29209090

FAQ

What is (1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0,2,6]decan-4-yl]butan-1-amine, trifluoroacetic acid (CAS: 179324-87-9)?
This compound is a complex organic molecule featuring a borate ring system and an amine functional group. Its chemical structure includes stereochemistry (1R, 1S,2S,6R,8S) and is stabilized by a trifluoroacetic acid moiety. It is commonly used in specialized chemical applications due to its unique molecular properties and reactivity.

What are the main uses of (1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0,2,6]decan-4-yl]butan-1-amine, trifluoroacetic acid (CAS: 179324-87-9)?
This compound is primarily utilized in pharmaceutical research for drug development, organic synthesis as a reagent, and industrial processes requiring precise functional group manipulation. Its applications may also extend to catalytic reactions and chemical intermediates in specialized laboratories.

Is (1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0,2,6]decan-4-yl]butan-1-amine, trifluoroacetic acid (CAS: 179324-87-9) safe?
Safety precautions are essential when handling this compound. It may exhibit toxicity due to its chemical structure, necessitating proper protective equipment and ventilation. Always adhere to safety standards outlined in the Material Safety Data Sheet (MSDS) and follow established protocols for chemical exposure and disposal.

How should (1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0,2,6]decan-4-yl]butan-1-amine, trifluoroacetic acid (CAS: 179324-87-9) be stored?
Store this compound in a cool, dry place away from light. Keep it in a sealed container to prevent moisture absorption and maintain stability. Ensure storage conditions are controlled to avoid degradation, and follow safety guidelines for handling reactive chemical compounds.

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Supplier Information

Shandong Platium Source Pharmaceutical Co., Ltd.

CAS Number: 179324-87-9

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Nantong Zhonghe Chemical New Materials Co., Ltd.

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HangZhouPanYu Chemical Co Ltd

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Wuhan HuJiu Medicine Technology Co., Ltd.

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(1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0,2,6]decan-4-yl]butan-1-amine, trifluoroacetic acid — JiangSuAiKangShengWuYiYaoYanFa Co Ltd

JiangSuAiKangShengWuYiYaoYanFa Co Ltd

CAS Number: 179324-87-9

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(1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0,2,6]decan-4-yl]butan-1-amine, trifluoroacetic acid — Jin Jinle (Hunan) Chemical Co., Ltd.

Jin Jinle (Hunan) Chemical Co., Ltd.

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Hubei Zhongshan Fenge Yongxue Keji Co., Ltd.

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(1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0,2,6]decan-4-yl]butan-1-amine, trifluoroacetic acid — Beijing Bailingwei Technology Co., Ltd.

Beijing Bailingwei Technology Co., Ltd.

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JiDaYiYaoHuaGong （ ShangHai ） Co Ltd

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(1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0,2,6]decan-4-yl]butan-1-amine, trifluoroacetic acid — HuBeiYongKuo Technology Co Ltd

HuBeiYongKuo Technology Co Ltd

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Shanghai Hansi Chemical Co., Ltd.

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BeiJingBangGuiYaoWuYanJiu Co Ltd

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(1R)-3-methyl-1-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0,2,6]decan-4-yl]butan-1-amine, trifluoroacetic acid — HePeng （ ShangHai ） Biotechnology Co Ltd

HePeng （ ShangHai ） Biotechnology Co Ltd

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Nanjing Dongmo Medicine Technology Co., Ltd.

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HuBeiXinKangYaoHuaYouXianGongSiHuaXueYanJiuSuo

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