Shanghai Minbiotech

CAS 156077-56-4

Chemistry, 1 End Use API, 16 Related Intermediates

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

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4,4-dimethyl-3,5,8- trioxabicyclo[5.1.0]octane

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CAS Number

57280-22-5

End Use API

Headquartered in Fengxian District, Shanghai Minbiotch Co., Ltd. is a company specializing in the R&D ...

Headquartered in Fengxian District, Shanghai Minbiotch Co., Ltd. is a company specializing in the R&D and production of advanced pharmaceutical intermediates and biological APIs. There are more than 1000 square meters of R&D centers in Nantong, Jiangsu and Jinan, Shandong, with more than 13,000㎡ of production sites. While supplying products to customers, the company also provides services such as technology development, technology transfer and technology exchange, aiming to provide customers with comprehensive supply and solutions in the biomedical industry.