CAS 168960-19-8

Chemistry, 3 End Use API, 11 Related Intermediates

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Also known as: 168960-19-8, (1s,4r)-4-amino-cyclopent-2-enyl-methanol hydrochloride, 2-cyclopentene-1-methanol, 4-amino-, hydrochloride, (1s,4r)-, (1s,4r)-(4-aminocyclopent-2-enyl)methanol hydrochloride, [(1s,4r)-4-aminocyclopent-2-en-1-yl]methanol;hydrochloride, Schembl4498187

Molecular Formula

C₆H₁₂ClNO

Molecular Weight

149.62 g/mol

InChI Key

DFJSXBUVSKWALM-IBTYICNHSA-N

1 2D Structure

CAS 168960-19-8

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

[(1S,4R)-4-aminocyclopent-2-en-1-yl]methanol;hydrochloride

2.1.2 InChI

InChI=1S/C6H11NO.ClH/c7-6-2-1-5(3-6)4-8;/h1-2,5-6,8H,3-4,7H2;1H/t5-,6+;/m1./s1

2.1.3 InChI Key

DFJSXBUVSKWALM-IBTYICNHSA-N

2.1.4 Canonical SMILES

C1C(C=CC1N)CO.Cl

2.1.5 Isomeric SMILES

C1[C@@H](C=C[C@@H]1N)CO.Cl

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 168960-19-8

2. (1s,4r)-4-amino-cyclopent-2-enyl-methanol Hydrochloride

3. 2-cyclopentene-1-methanol, 4-amino-, Hydrochloride, (1s,4r)-

4. (1s,4r)-(4-aminocyclopent-2-enyl)methanol Hydrochloride

5. [(1s,4r)-4-aminocyclopent-2-en-1-yl]methanol;hydrochloride

6. Schembl4498187

7. Dtxsid90703775

8. Dtxsid701015728

9. Srca-00006

10. Mfcd01632106

11. Akos025287181

12. Ds-9476

13. Db-126395

14. Cs-0162437

15. D70763

16. (1s,4r)-4-amino-2-cyclopentene-1-methanol Hcl

17. [(1r,4s)-4-4-amino-2-cyclopentene-1-methanol Hcl

18. ((1s,4r)-4-aminocyclopent-2-en-1-yl)methanolhydrochloride

19. (+/-)-cis-4-amino-2-cyclopentene-1-methanol Hydrochloride

20. (+)-(1s,4r)-4-amino-2-cyclopentene-1-methanol Hydrochloride

21. (1r, 4s)-1-amino-4-hydroxymethyl-2-cyclopentene Hydrochloride

22. (1r,4s)-1-amino-4-hydroxymethyl-2-cyclopentene Hydrochloride

23. [(1s,4r)-4-amino-2-cyclopenten-1-yl]methanol Hydrochloride

24. ((1s,4r)-4-aminocyclopent-2-en-1-yl)methanol Hydrochloride (1:1)

25. (1r, 4 S)-1- Amino-4-(hydroxymethyl)-2-cyclopentene Hydrochloride

26. (1r, 4 S)-1-amino-4-(hydroxymethyl)-2-cyclopentene Hydrochloride

27. (1r, 4s)-1-amino-4-(hydroxymethyl)-2-cyclopentene Hydrochloride

28. (1r,4s)-1-amino-4-(hydroxymethyl)-2-cyclo-pentene Hydrochloride

29. (1r,4s)-1-amino-4-(hydroxymethyl)-2-cyclopentene Hydrochloride

30. [(1s,4r)-4-amino-2-cyclopenten-1-yl]methanol Hydrochloride (1:1)

31. 2-cyclopentene-1-methanol, 4-amino-, Hydrochloride (1:1), (1s,4r)-

32. Sriramchem-[(1s,4r)-4-aminocyclopent-2-en-1-yl]methanol;hydrochloride

2.3 Create Date

2011-11-07

3 Chemical and Physical Properties

Molecular Formula	C₆H₁₂ClNO
Molecular Weight	149.62 g/mol
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	149.0607417 g/mol
Monoisotopic Mass	149.0607417 g/mol
Topological Polar Surface Area	46.2 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	101
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2

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CAS Number

168960-19-8

Intermediate Name

(1S 4R)-4-Amino-2-cyclopentene-meth...

About the Company

Kopalle Pharma is a trusted manufacturer of Active Pharma Ingredients (API’s) & Intermediates. Kopalle ...

Kopalle Pharma is a trusted manufacturer of Active Pharma Ingredients (API’s) & Intermediates. Kopalle Pharma Chemicals Pvt Ltd is an ISO 9001:2015 Certified Company and has a GMP Certified manufacturing facility at Jeedimetla, Hyderabad.

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168960-19-8

Intermediate Name

(1S,4R)-(4-Aminocyclopent-2-enyl)me...

About the Company

Kosher Pharmaceutical Pvt ltd is a privately owned and professionally managed Organization with its corpo...

Kosher Pharmaceutical Pvt ltd is a privately owned and professionally managed Organization with its corporate office located at Ameerpet , Hyderabad and manufacturing facility located at Jagdevpur Village & Mandal in Siddipet District. Kosher Pharmaceutical Pvt ltd provides innovative & integrated API solutions with it's decades of experience and skill in the development of novel chemical processes catering to the generic companies. Kosher Pharmaceutical Pvt ltd is committed to respecting third party intellectual property rights, manufacture products which are commercially competitive and meet the most stringent quality standards. Besides manufacturing its own Active Pharmaceutical Ingredients (APIs) & Advanced Intermediates, we also contract manufacture for global generic companies.

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About the Company

Haorui, established in 1997, is a manufacturer and supplier of APIs, intermediates, veterinary and food a...

Haorui, established in 1997, is a manufacturer and supplier of APIs, intermediates, veterinary and food additives. Meanwhile, it is assisting global pharmaceutical companies to get the domestic registration of their finished dosage for their international expansion. Our USFDA approved products Flumazenil, Granisetron HCl, Granisetron Base, Docetaxel Anhydrous, Irinotecan HCl, Dasatinib Monohydrate, Oxaliplatin and Temozolomide have been recognized by our customers globally. In addition, our Amisulpride API acquired CEP, UK GMP & USDMF.

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