tert-butyl 4-hydroxy-3-MethoxybenzylcarbaMate | CAS No. 130972-89-3

tert-butyl 4-hydroxy-3-MethoxybenzylcarbaMate

Basic Information

CAS Number

130972-89-3

Molecular Formula

C13H19NO4

Molecular Weight

253.3 g/mol

AD

Basic Physical Properties

CC(C)(C)OC(=O)NCC1=CC(=C(C=C1)O)OC

InChI

InChI=1S/C13H19NO4/c1-13(2,3)18-12(16)14-8-9-5-6-10(15)11(7-9)17-4/h5-7,15H,8H2,1-4H3,(H,14,16)

InChIKey

SAFGFWHMYJRFPH-UHFFFAOYSA-N

LogP

2.425500000000001

Topological Polar Surface Area

67.79 Ų

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

275

Synonyms & References

English

  • Carbamic acid, [(4-hydroxy-3-methoxyphenyl)methyl]-, 1,1-dimethylethylester
  • TERT-BUTYL N-(4-HYDROXY-3-METHOXYBENZYL)CARBAMATE
  • tert-butyl 4-hydroxy-3-MethoxybenzylcarbaMate
  • tert-butyl N-(4-hydroxy-3-methoxyphenyl)methylcarbamate
  • BS-44773
  • t-Boc-vanillylamine
  • tert-butyl N-[(4-hydroxy-3-methoxyphenyl)methyl]carbamate
  • tert-butyl4-hydroxy-3-MethoxybenzylcarbaMate
  • F75798
  • DB-266936
  • SCHEMBL2574214
  • tert-butyl(4-hydroxy-3-methoxybenzyl)carbamate
  • 130972-89-3
  • EN300-12460152
  • SAFGFWHMYJRFPH-UHFFFAOYSA-N

MDL Number

MFCD24448663

FAQ

What are the physical and chemical properties of tert-butyl 4-hydroxy-3-MethoxybenzylcarbaMate (CAS: 130972-89-3)?

Tert-butyl 4-hydroxy-3-MethoxybenzylcarbaMate (CAS: 130972-89-3) is a white crystalline solid with a molecular weight of approximately 285.35 g/mol. It is slightly soluble in water and more soluble in organic solvents like methanol and ethanol. It is known for its high reactivity towards nucleophiles and bases due to its phenolic and methoxy groups.

How is tert-butyl 4-hydroxy-3-MethoxybenzylcarbaMate (CAS: 130972-89-3) typically synthesized?

Tert-butyl 4-hydroxy-3-MethoxybenzylcarbaMate is commonly synthesized through a multi-step process involving the protection of a hydroxyl group followed by a benzyl substitution reaction. The synthesis typically uses tert-butyldimethylsilyl chloride as a protecting agent and catalytic amounts of a Lewis acid such as BF3•OEt2 to facilitate the benzylation step. The yield and selectivity can be optimized through careful choice of reaction conditions.

What industries use tert-butyl 4-hydroxy-3-MethoxybenzylcarbaMate (CAS: 130972-89-3)?

Tert-butyl 4-hydroxy-3-MethoxybenzylcarbaMate is used in various industries, particularly in pharmaceuticals for the synthesis of active pharmaceutical ingredients (APIs) and as a precursor in polymer chemistry for the development of functional polymers. It also has applications in the production of sensors and semiconductors due to its unique chemical properties.

What precautions should be taken when handling tert-butyl 4-hydroxy-3-MethoxybenzylcarbaMate (CAS: 130972-89-3)?

When handling tert-butyl 4-hydroxy-3-MethoxybenzylcarbaMate (CAS: 130972-89-3), it is essential to wear appropriate personal protective equipment (PPE), including gloves and safety goggles. Work should be conducted in a well-ventilated area or a fume hood to minimize exposure to the compound. Spills should be cleaned up immediately using appropriate neutralizing agents and rinsing with copious amounts of water. Always refer to the Safety Data Sheet (SDS) for detailed handling and emergency procedures.

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