(1R,3S)-3-(tert-Butoxycarbonylamino)cyclohexanecarboxylic Acid
[CAS# 222530-33-8]

Identification

• Classification: Biochemical >> Amino acids and their derivatives >> Other amino acid derivatives
• Name: (1R,3S)-3-(tert-Butoxycarbonylamino)cyclohexanecarboxylic Acid
• Molecular Formula: C₁₂H₂₁NO₄
• Molecular Weight: 243.30
• CAS Registry Number: 222530-33-8
• EC Number: 852-521-5
• SMILES: CC(C)(C)OC(=O)N[C@H]1CCC[C@H](C1)C(=O)O

Properties

• Solubility: 276.5 mg/L (25 ºC water)
• Density: 1.1±0.1 g/cm³, Calc.^*
• Index of Refraction: 1.494, Calc.^*
• Melting point: 121.49 ºC
• Boiling Point: 350.50 ºC, 396.7±31.0 ºC (760 mmHg), Calc.^*
• Flash Point: 193.7±24.8 ºC, Calc.^*

^* Calculated using Advanced Chemistry Development (ACD/Labs) Software.

Safety Data

• Hazard Symbols: GHS07 Warning
• Hazard Statements: H315-H319-H335
• Precautionary Statements: P261-P305+P351+P338

Hazard Classification

Hazard	Class	Category Code	Hazard Statement
Skin irritation	Skin Irrit.	2	H315
Eye irritation	Eye Irrit.	2A	H319
Specific target organ toxicity - single exposure	STOT SE	3	H335