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CAS 83863-71-2

CAS 83863-71-2

Chemistry, 1 End Use API, 1 Related Intermediates

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CAS 83863-71-2

Also known as: 83863-71-2, Ethyl (3s,4r)-4-amino-3-methoxypiperidine-1-carboxylate;hydrochloride, 1-piperidinecarboxylicacid, 4-amino-3-methoxy-, ethyl ester, hydrochloride (1:1), (3r,4s)-rel-, Einecs 281-137-5, Dtxsid40232762

Molecular Formula

C₉H₁₉ClN₂O₃

Molecular Weight

238.71 g/mol

InChI Key

JUIQWDFWJKAYQH-WLYNEOFISA-N

1 2D Structure

CAS 83863-71-2

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

ethyl (3S,4R)-4-amino-3-methoxypiperidine-1-carboxylate;hydrochloride

2.1.2 InChI

InChI=1S/C9H18N2O3.ClH/c1-3-14-9(12)11-5-4-7(10)8(6-11)13-2;/h7-8H,3-6,10H2,1-2H3;1H/t7-,8+;/m1./s1

2.1.3 InChI Key

JUIQWDFWJKAYQH-WLYNEOFISA-N

2.1.4 Canonical SMILES

CCOC(=O)N1CCC(C(C1)OC)N.Cl

2.1.5 Isomeric SMILES

CCOC(=O)N1CC[C@H]([C@H](C1)OC)N.Cl

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 83863-71-2

2. Ethyl (3s,4r)-4-amino-3-methoxypiperidine-1-carboxylate;hydrochloride

3. 1-piperidinecarboxylicacid, 4-amino-3-methoxy-, Ethyl Ester, Hydrochloride (1:1), (3r,4s)-rel-

4. Einecs 281-137-5

5. Dtxsid40232762

2.3 Create Date

2009-08-20

3 Chemical and Physical Properties

Molecular Formula	C₉H₁₉ClN₂O₃
Molecular Weight	238.71 g/mol
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	238.1084202 g/mol
Monoisotopic Mass	238.1084202 g/mol
Topological Polar Surface Area	64.8 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	199
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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Vasudha Pharma Chem Limited

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Digital Content

Ethyl 4-amino-3-methoxypiperidine-1-carboxylate hydroch...

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CAS Number

83863-71-2

End Use API

Cisapride Monohydrate

About the Company

VASUDHA PHARMA CHEM LIMITED was incorporated, as a public limited company under the Companies Act, 1956 i...

VASUDHA PHARMA CHEM LIMITED was incorporated, as a public limited company under the Companies Act, 1956 in 1994-95 at Hyderabad in the state of Telangana, India. The company is engaged in the manufacturing of Active Pharmaceutical Ingredients (APIs), Pharma Intermediates for catering to the Global market. Initially, the focus was on the development of cost effective processes for several intermediates related to piperidone & piperidine derivatives. By 2003-04, the company gained world class expertise and became the largest manufacturer of piperidone & piperidine derivatives in the world.

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