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CAS 156077-56-4

CAS 156077-56-4

Chemistry, 1 End Use API, 16 Related Intermediates

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CAS 156077-56-4

Also known as: 156077-56-4, Amy5918, Mfcd32898412, 3-(1,4,7,10-tetraaza-1-cyclododecyl)-1,2,4-butanetriol tetrahydrochloride, Ac-31771, Sy286646

Molecular Formula

C₁₂H₃₂Cl₄N₄O₃

Molecular Weight

422.2 g/mol

InChI Key

FYFSGGAVTBSKBV-UHFFFAOYSA-N

1 2D Structure

CAS 156077-56-4

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

3-(1,4,7,10-tetrazacyclododec-1-yl)butane-1,2,4-triol;tetrahydrochloride

2.1.2 InChI

InChI=1S/C12H28N4O3.4ClH/c17-9-11(12(19)10-18)16-7-5-14-3-1-13-2-4-15-6-8-16;;;;/h11-15,17-19H,1-10H2;4*1H

2.1.3 InChI Key

FYFSGGAVTBSKBV-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1CNCCN(CCNCCN1)C(CO)C(CO)O.Cl.Cl.Cl.Cl

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 156077-56-4

2. Amy5918

3. Mfcd32898412

4. 3-(1,4,7,10-tetraaza-1-cyclododecyl)-1,2,4-butanetriol Tetrahydrochloride

5. Ac-31771

6. Sy286646

7. 3-(1,4,7,10-tetrazacyclododec-1-yl)butane-1,2,4-triol;tetrahydrochloride

8. 10-[(1rs,2sr)-2,3-dihydroxy-1-(hydroxymethyl)propyl]-1,4,7,10-tetraazacyclododecan . 4hcl

2.3 Create Date

2007-12-05

3 Chemical and Physical Properties

Molecular Formula	C₁₂H₃₂Cl₄N₄O₃
Molecular Weight	422.2 g/mol
Hydrogen Bond Donor Count	10
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	4
Exact Mass	422.119902 g/mol
Monoisotopic Mass	420.122852 g/mol
Topological Polar Surface Area	100 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	209
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	5

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Biophore India Pharmaceuticals Pvt ...

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

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Cyclen (Intermediate)

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CAS Number

294-90-6

End Use API

Gadobutrol

About the Company

Biophore, founded in 2007, has established itself as a reliable partner in the development and manufactur...

Biophore, founded in 2007, has established itself as a reliable partner in the development and manufacturing of niche and complex pharmaceutical products. With 4 USFDA and EU-approved API manufacturing facilities, a dedicated intermediate facility, and a R&D laboratory housing 400 scientists, Biophore has positioned itself as a global leader among API companies. It consistently ranks among the top 10 US DMF filers and has obtained over 150 patents worldwide in process and polymorph areas. Biophore's facilities have an impressive track record of successful audits by regulatory bodies such as USFDA, EMEA, ANVISA, COFEPRIS, and WHO GMP.

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Farmhispania Group, a leading European CDMO in HPAPI Technologies & High Potency Fermentation.

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