CAS 1210348-34-7

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Also known as: 1210348-34-7, Tert-butyl n-[(1r,2s,5s)-2-amino-5-(dimethylcarbamoyl)cyclohexyl]carbamate oxalate, Tert-butyl [(1r,2s,5s)-2-amino-5-[(dimethylamino)carbonyl]cyclohexyl]carbamate oxalate, Tert-butyl n-[(1r,2s,5s)-2-amino-5-(dimethylcarbamoyl)cyclohexyl]carbamate;oxalic acid, 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

Molecular Formula

C₁₆H₂₉N₃O₇

Molecular Weight

375.42 g/mol

InChI Key

IERZZGXDUZIMSC-PBDVDRNWSA-N

1 2D Structure

CAS 1210348-34-7

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

tert-butyl N-[(1R,2S,5S)-2-amino-5-(dimethylcarbamoyl)cyclohexyl]carbamate;oxalic acid

2.1.2 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

2.1.3 InChI Key

IERZZGXDUZIMSC-PBDVDRNWSA-N

2.1.4 Canonical SMILES

CC(C)(C)OC(=O)NC1CC(CCC1N)C(=O)N(C)C.C(=O)(C(=O)O)O

2.1.5 Isomeric SMILES

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

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 1210348-34-7

2. Tert-butyl N-[(1r,2s,5s)-2-amino-5-(dimethylcarbamoyl)cyclohexyl]carbamate Oxalate

3. Tert-butyl [(1r,2s,5s)-2-amino-5-[(dimethylamino)carbonyl]cyclohexyl]carbamate Oxalate

4. Tert-butyl N-[(1r,2s,5s)-2-amino-5-(dimethylcarbamoyl)cyclohexyl]carbamate;oxalic Acid

5. Tert - Butyl [(1r,2s,5s) - 2 - Amino - 5 - [(dimethylamino)carbonyl]cyclohexyl]carbamate Oxalate

6. Tert-butyl ((1r,2s,5s)-2-amino-5-((dimethylamino)carbonyl)cyclohexyl)carbamate Oxalate

7. Tert-butyl {(1r,2s,5s)-2-amino-5-[(dimethylamino)carbonyl]cyclohexyl}carbamate Oxalate

8. Ethanediamide Impurity A

9. Amy19407

10. Cs-m3400

11. Mfcd28501698

12. Akos025289771

13. Ds-7605

14. Tert-butyl[(1r,2s,5s)-2-amino-5-[(dimethylamino)carbonyl]cyclohexyl]carbamate Oxalate

15. P15585

16. A851763

17. T-butyl {(1r,2s,5s)-2-amino-5-[(dimethylamino)carbonyl]cyclohexyl}carbamate Oxalate

18. Tert-butyl((1r,2s,5s)-2-amino-5-(dimethylcarbamoyl)cyclohexyl)carbamateoxalate

19. Tert-butyl(1r,2s,5s)-2-amino-5-[(dimethylamino)carbonyl]cyclohexylcarbamate Oxalate

2.3 Create Date

2010-10-18

3 Chemical and Physical Properties

Molecular Formula	C₁₆H₂₉N₃O₇
Molecular Weight	375.42 g/mol
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	5
Exact Mass	375.20055027 g/mol
Monoisotopic Mass	375.20055027 g/mol
Topological Polar Surface Area	159 Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	435
Isotope Atom Count	0
Defined Atom Stereocenter Count	3
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2

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SUPPLIERS

01 Shandong Chenghui Shuangda Pharmaceuti...

China

CPhI Japan

Exhibiting

China's leading API and intermediate manufacturer, offering CMO/CDMO services and exports to 70+ countries, enhancing global health.

tert-Butyl [(1R,2S,5S)-2-amino-5-[(dimethylamino)c...

CAS Number : 1210348-34-7

End Use API : Edoxaban Tosylate

Shandong Chenghui Shuangda Pharmaceutical

02 Shanghai Minbiotech

China

BIO Partnering at JPM

Not Confirmed

Shanghai Minbiotech is the leading producer of biopharmaceuticals and a variety of high-end generic & innovative drugs.

tert-Butyl [(1R,2S,5S)-2- amino-5- [(dimethylamino...

CAS Number : 1210348-34-7

End Use API : Edoxaban Tosylate

Corporate PDF

03 Shanghai Minbiotech

China

BIO Partnering at JPM

Not Confirmed

Shanghai Minbiotech is the leading producer of biopharmaceuticals and a variety of high-end generic & innovative drugs.

tert-Butyl [(1R,2S,5S)-2-amino-5- [(dimethylamino)...

CAS Number : 1210348-34-7

End Use API : Edoxaban Tosylate

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Tert-Butyl[(1R,2S,5S)-2-amino-5-[(dimethylamino)ca...

BIO Partnering at JPM

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END USE APIs

01

Edoxaban Tosylate

Ami Lifesciences Private ...

India

AMI Lifesciences is Driven by Chemistry. Powered by People.

Metrochem API Private Lim...

India

Metrochem has been delivering customized volume & quality products to customers across the world, taking utmost care of their needs.

Biophore India Pharmaceut...

India

Biophore is a research-driven global pharmaceutical company focused on niche APIs for the generic industry.

LGM Pharma

U.S.A

LGM Pharma accelerates & optimizes the new product pathway from early development through commercialization.

Nuray Chemicals Private L...

India

Nuray is an expert in the synthesis of Niche novel APIs, the first to launch Generics, NCEs, Advanced Intermediates // USFDA certified.

Rochem International Inc

U.S.A

Rochem, your partner in developing, sourcing, and supplying pharmaceutical & animal health ingredients of Chinese origin.

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INTERMEDIATES

Various Intermediates needed in India [ENA13881]

A company that focused in research, development and manufacturing of APIs is looking for suppliers of Various Intermediates for both development & commercial purpose. The required quantity is 100 kg - 1 MT for each. The suppliers must support this enquiry with CoA. 1. CAS 720720-96-7 Intermediate 2. CAS 1210348-34-7 Intermediate 3. CAS 1243308-37-3 Intermediate

07 Jun 2022

Edoxaban intermediate needed in Taiwan [ENA06044]

A biomedical company manufacturing a wide range of pharmaceutical products, including pain management, antifungal, and immunosuppressant is looking for suppliers of Edoxaban intermediate (CAS No. 1210348-34-7). Please make a quotation based on 10kg, 100 kg, and 1000 kg and send the supplier must support with CoA.

12 Dec 2019

Edoxaban (15 kg) intermediate needed in India [ENA04983]

A pharmaceutical company providing intelligent and innovative chemistry solutions to pharmaceutical, biotech companies worldwide is looking for suppliers of Edoxaban (15 kg) intermediate tert-Butyl [(1R,2S,5S)-2-amino-5-[(dimethylamino)carbonyl]cyclohexyl oxalate (Cas No. 1210348-34-7). The supplier must support this enquiry with CoA. The required commercial quantity is about 500 kg.

26 Aug 2019

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Srini Pharmaceuticals

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