HLXCXOQXUDRJLF-VRZFHARJSA-N

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Valsynthese, part of the SSE Group, is a CDMO focused on highly energetic and highly hazardous chemistry.

CHEMISTRY

Discover Molecule Insights

BUILDING BLOCK

1 Suppliers, 1 End Use APIs, 7 Related Intermediates

1 Suppliers
1 End Use APIs
7 Related Intermediates

Chemistry

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Also known as: Schembl4056981, Akos015888113

Molecular Formula

C₁₅H₂₀ClNO₂

Molecular Weight

281.78 g/mol

InChI Key

HLXCXOQXUDRJLF-VRZFHARJSA-N

1 2D Structure

HLXCXOQXUDRJLF-VRZFHARJSA-N

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

benzyl (3aR,6aR)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[b]pyrrole-2-carboxylate;hydrochloride

2.1.2 InChI

InChI=1S/C15H19NO2.ClH/c17-15(18-10-11-5-2-1-3-6-11)14-9-12-7-4-8-13(12)16-14;/h1-3,5-6,12-14,16H,4,7-10H2;1H/t12-,13-,14?;/m1./s1

2.1.3 InChI Key

HLXCXOQXUDRJLF-VRZFHARJSA-N

2.1.4 Canonical SMILES

C1CC2CC(NC2C1)C(=O)OCC3=CC=CC=C3.Cl

2.1.5 Isomeric SMILES

C1C[C@@H]2CC(N[C@@H]2C1)C(=O)OCC3=CC=CC=C3.Cl

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. Schembl4056981

2. Akos015888113

2.3 Create Date

2007-12-04

3 Chemical and Physical Properties

Molecular Formula	C₁₅H₂₀ClNO₂
Molecular Weight	281.78 g/mol
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	281.1182566 g/mol
Monoisotopic Mass	281.1182566 g/mol
Topological Polar Surface Area	38.3 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	299
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2

BUILDING BLOCK

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SUPPLIERS

01

Zhejiang Huahai Pharmaceutical Co., Lt...

Endo,cis-2-azabicyclo[3,3,0]octane-3-carboxylic ac...

Medlab Asia & Asia Health

Not Confirmed

Zhejiang Huahai Pharmaceutical Co., Lt...

China

Medlab Asia & Asia Health

Not Confirmed

Boost your online visibility by uploading your products, APIs, FDFs, intermediates, excipients, and services for free on PharmaCompass. Rank higher among suppliers and expand your reach across the internet efficiently and cost-effectively.

Endo,cis-2-azabicyclo[3,3,0]octane-3-carboxylic ac...

CAS Number : 93779-29-4

End Use API :

End Use API : Ramipril

About the Company : Zhejiang Huahai Pharmaceuticals Co., Ltd.was initially founded in 1989, and the company's stock was successfully listed in Shanghai Stock Exchange in March, 2003. Huahai Pharmaceutical...

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