tert-Butyl-trans-3-(aminomethyl)cyclohexylcarbamate

• Catalog Number: ACMA00002213
• Category: Ethers
• Molecular Weight: 228.33
• Molecular Formula: C₁₂H₂₀N₂O
• Hazard Statements: H302
• RIDADR: UN 3077 9 / PGIII
• Symbol: GHS07

Custom Q&A

What is the molecular formula of tert-Butyl-trans-3-(aminomethyl)cyclohexylcarbamate?

The molecular formula is C12H24N2O2.

What are the synonyms for tert-Butyl-trans-3-(aminomethyl)cyclohexylcarbamate?

The synonyms are 1222709-27-4, tert-Butyl trans-3-(aminomethyl)cyclohexylcarbamate, TERT-BUTYL N-[(1R,3R)-3-(AMINOMETHYL)CYCLOHEXYL]CARBAMATE, tert-Butyl ((1R,3R)-rel-3-(aminomethyl)cyclohexyl)carbamate.

What is the molecular weight of tert-Butyl-trans-3-(aminomethyl)cyclohexylcarbamate?

The molecular weight is 228.33 g/mol.

What is the IUPAC name of tert-Butyl-trans-3-(aminomethyl)cyclohexylcarbamate?

The IUPAC name is tert-butyl N-[(1R,3R)-3-(aminomethyl)cyclohexyl]carbamate.

What is the InChI of tert-Butyl-trans-3-(aminomethyl)cyclohexylcarbamate?

The InChI is InChI=1S/C12H24N2O2/c1-12(2,3)16-11(15)14-10-6-4-5-9(7-10)8-13/h9-10H,4-8,13H2,1-3H3,(H,14,15)/t9-,10-/m1/s1.

What is the InChIKey of tert-Butyl-trans-3-(aminomethyl)cyclohexylcarbamate?

The InChIKey is OJNXXJZVUYXMLE-NXEZZACHSA-N.

What is the canonical SMILES of tert-Butyl-trans-3-(aminomethyl)cyclohexylcarbamate?

The canonical SMILES is CC(C)(C)OC(=O)NC1CCCC(C1)CN.

What is the isomeric SMILES of tert-Butyl-trans-3-(aminomethyl)cyclohexylcarbamate?

The isomeric SMILES is CC(C)(C)OC(=O)N[C@@H]1CCC[C@H](C1)CN.

What is the XLogP3-AA value of tert-Butyl-trans-3-(aminomethyl)cyclohexylcarbamate?

The XLogP3-AA value is 1.5.

Is tert-Butyl-trans-3-(aminomethyl)cyclohexylcarbamate a canonicalized compound?

Yes, it is a canonicalized compound.