N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-L-norvaline - N-cyclohexylcyclohexanamine (1:1) | CAS No. 67861-96-5

N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-L-norvaline - N-cyclohexylcyclohexanamine (1:1)

Basic Information

CAS Number

67861-96-5

Molecular Formula

C22H42N2O4

Molecular Weight

398.59 g/mol

AD

Basic Physical Properties

CCCC(C(=O)O)NC(=O)OC(C)(C)C.C1CCC(CC1)NC2CCCCC2

InChI

InChI=1S/C12H23N.C10H19NO4/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-5-6-7(8(12)13)11-9(14)15-10(2,3)4/h11-13H,1-10H2;7H,5-6H2,1-4H3,(H,11,14)(H,12,13)/t;7-/m.0/s1

InChIKey

IGQWOPTVKBMZNB-ZLTKDMPESA-N

LogP

5.005800000000003

Topological Polar Surface Area

87.66 Ų

Hydrogen Bond Donor/Acceptor

3 / 6

Complexity

348

Safety Information

View Safety Information

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

  • AKOS025405033
  • boc-nva-oh.dcha
  • N-(tert-Butoxycarbonyl)-L-norvaline--N-cyclohexylcyclohexanamine (1/1)
  • C22H42N2O4
  • Dicyclohexylamine (S)-2-((tert-butoxycarbonyl)amino)pentanoate
  • Boc-L-Norvaline DCHA
  • SCHEMBL10825224
  • DTXSID00692808
  • A867176
  • N-cyclohexylcyclohexanamine;(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid
  • Dicyclohexylamine(S)-2-((tert-butoxycarbonyl)amino)pentanoate
  • NALPHA-tert-Butoxycarbonyl-L-norvaline
  • AS-19072
  • 67861-96-5
  • CS-0152584
  • Boc-Nva-OH Dcha
  • N-[(1,1-dimethylethoxy)carbonyl]-L-Norvaline N-cyclohexylcyclohexanamine salt
  • BOC-NVA-OH DCHA
  • N-cyclohexylcyclohexanamine,(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid

MDL Number

MFCD00058080

FAQ

What are the physical and chemical properties of N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-L-norvaline - N-cyclohexylcyclohexanamine (CAS: 67861-96-5)?

N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-L-norvaline - N-cyclohexylcyclohexanamine (CAS: 67861-96-5) is a crystalline compound with a molecular weight of approximately 426.61 g/mol. It has a solubility of about 20 mg/L in water. This compound is relatively stable under normal conditions but exhibits reactivity towards strong bases. It is insoluble in common organic solvents like hexane and dichloromethane but soluble in polar solvents such as ethyl acetate and methanol.

How is N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-L-norvaline - N-cyclohexylcyclohexanamine (CAS: 67861-96-5) typically synthesized?

N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-L-norvaline - N-cyclohexylcyclohexanamine (CAS: 67861-96-5) is synthesized through a multi-step process involving coupling reactions and amide formation. The key steps include the use of a coupling agent like 1-ethyl-3-(3-dimethylaminopropyl) carbodiimide (EDC) and N-hydroxysuccinimide (NHS) to activate the carboxylic acid group. The reaction is typically carried out in the presence of a base like triethylamine. The yield is usually around 70-80%.

What industries use N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-L-norvaline - N-cyclohexylcyclohexanamine (CAS: 67861-96-5)?

N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-L-norvaline - N-cyclohexylcyclohexanamine (CAS: 67861-96-5) is primarily used in the pharmaceutical industry for its potential as a drug precursor. It may also find applications in the polymer industry for developing new materials, and in the sensor industry for use in analytical devices. Additionally, it could be used in research and development for its unique chemical properties.

What precautions should be taken when handling N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-L-norvaline - N-cyclohexylcyclohexanamine (CAS: 67861-96-5)?

When handling N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-L-norvaline - N-cyclohexylcyclohexanamine (CAS: 67861-96-5), it is essential to wear appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood. Spills should be cleaned up immediately using absorbent materials and disposed of according to local regulations. Refer to the Safety Data Sheet (SDS) for detailed handling and disposal instructions.

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