2-Methyl-2-propanyl [(1R,2S,5S)-2-amino-5-(dimethylcarbamoyl)cyclohexyl]carbamate ethanedioate (1:1) | CAS No. 1210348-34-7

2-Methyl-2-propanyl [(1R,2S,5S)-2-amino-5-(dimethylcarbamoyl)cyclohexyl]carbamate ethanedioate (1:1)

Basic Information

CAS Number

1210348-34-7

Molecular Formula

C16H29N3O7

Molecular Weight

375.42 g/mol

EINECS

1592732-453-0

AD

Basic Physical Properties

OC(=O)C(=O)O.O=C(OC(C)(C)C)N[C@@H]1C[C@H](CC[C@@H]1N)C(=O)N(C)C

InChI

InChI=1S/C14H27N3O3.C2H2O4/c1-14(2,3)20-13(19)16-11-8-9(6-7-10(11)15)12(18)17(4)5;3-1(4)2(5)6/h9-11H,6-8,15H2,1-5H3,(H,16,19);(H,3,4)(H,5,6)/t9-,10-,11+;/m0./s1

InChIKey

IERZZGXDUZIMSC-PBDVDRNWSA-N

LogP

0.25090000000000173

Topological Polar Surface Area

159.26 Ų

Hydrogen Bond Donor/Acceptor

5 / 10

Complexity

435

Synonyms & References

English

  • Tert-Butyl(1R,2S,5S)-2-azido-5-[(diMethylaMino)carbonyl]cyclohexylcarbaMate oxalic acid
  • oxalic acid tert-butyl N-[(1R,2S,5S)-2-aMino-5-(diMethylcarbaMoyl)cyclohexyl]carbaMate
  • (2-Azido-5-diMethylcarbaMoyl-cyclohexyl)-carbaMic acid tert-butyl esteroxalic acid
  • EthanediaMide iMpurity A/Edoxaban Intermediate II
  • tert-butyl ((1R,2S,5S)-2-amino-5-(dimethylcarbamoyl)cyclohexyl)carbamate oxalic acid
  • Edoxaban-1
  • N-[(1R,2S,5S)-2-amino-5-[(dimethylamino)carbonyl]cyclohexyl]-Carbamic acid, 1,1-dimethylethyl ester, ethanedioate (1:1)
  • 2EthanediaMide iMpurity A
  • tert-Butyl ((1R,2S,5S)-2-amino-5-(dimethylcarbamoyl)cyclohexyl)carbamate oxalate
  • EthanediaMide iMpurity A
  • EthanediaMide iMpurity A oxalate
  • tert-Butyl N-[(1R,2S,5S)-2-amino-5-(dimethylcarbamoyl)cyclohexyl]carbamate oxalate
  • Edoxaban impurity A
  • Edoxaban Intermediate 2
  • (1S,2R,4S)-2-[(tert-Butoxycarbonyl)Amino ]-4-[( dimethylamino)carbonyl]- cyclohexyl ammonia oxalate
  • tert-Butyl[(1R,2S,5S)-2-amino-5-[(dimethylamino)carbonyl]cyclohexyl]carbamate oxalate
  • tert-Butyl [(1R,2S,5S)-2-amino-5-[(dimethylamino)carbonyl]cyclohexyl]carbamate oxalate
  • tert-butyl {(1R,2S,5S)-2-amino-5-[(dimethylamino)carbonyl]cyclohexyl}carbamate oxalate
  • IERZZGXDUZIMSC-PBDVDRNWSA-N
  • EthanediaMide iMpurity A
  • tert-butyl N-[(1R,2S,5S)-2-amino-5-(dimethylcarbamoyl)cyclohexyl]carbamate;oxalic acid
  • Edoxaban Impurity 1
  • tert-butyl N-[(1R,2S,5S)-2-amino-5-(dimethylcarbamoyl)cyclohexyl]carbamate oxalate

MDL Number

MFCD28501698

EC Number

1592732-453-0

FAQ

What is 2-Methyl-2-propanyl [(1R,2S,5S)-2-amino-5-(dimethylcarbamoyl)cyclohexyl]carbamate ethanedioate (1:1) (CAS: 1210348-34-7)?

2-Methyl-2-propanyl [(1R,2S,5S)-2-amino-5-(dimethylcarbamoyl)cyclohexyl]carbamate ethanedioate (1:1) is a complex organic compound with the CAS number 1210348-34-7. It features a cyclohexyl ring substituted with an amino group and a dimethylcarbamoyl group, connected to a carbamate ester and ethanedioate (malonic acid) moiety. This compound is known for its structural versatility in pharmaceutical and chemical applications.

What are the main uses of 2-Methyl-2-propanyl [(1R,2S,5S)-2-amino-5-(dimethylcarbamoyl)cyclohexyl]carbamate ethanedioate (1:1) (CAS: 1210348-34-7)?

This compound is primarily used in pharmaceutical research as an intermediate for drug development targeting neurological disorders. Its unique structure makes it valuable in creating molecules with potential applications in enzyme inhibition and receptor modulation. It is also employed in chemical synthesis for specialized compounds requiring precise functional group arrangements.

Is 2-Methyl-2-propanyl [(1R,2S,5S)-2-amino-5-(dimethylcarbamoyl)cyclohexyl]carbamate ethanedioate (1:1) (CAS: 1210348-34-7) safe?

Safety data for this compound is limited, but as a chemical intermediate, it should be handled with standard laboratory precautions. It may pose toxicity risks if inhaled, ingested, or exposed to skin, so protective equipment like gloves and ventilation is recommended. Always follow OSHA guidelines and avoid direct contact with the compound in industrial or research settings.

How should 2-Methyl-2-propanyl [(1R,2S,5S)-2-amino-5-(dimethylcarbamoyl)cyclohexyl]carbamate ethanedioate (1:1) (CAS: 1210348-34-7) be stored?

Store this compound in a cool, dry place away from moisture and light. Use airtight, dark-colored containers to maintain stability. Keep it at temperatures below 25°C (77°F) and avoid humidity exposure. Ensure proper labeling and secure storage to prevent contamination or accidental exposure in laboratories or storage facilities.

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