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CAS 501921-30-8

Chemistry, 2 End Use API, 32 Related Intermediates

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Also known as: 501921-30-8, (3as,6ar)-4-methoxy-3a,4,6,6a-tetrahydro-3h-furo[2,3-c]furan-2-one, (3as,6ar)-tetrahydro-4-methoxyfuro[3,4-b]furan-2(3h)-one, Tetrahydro-4-methoxyfuro[3,4-b]furan-2(3h)-one, Schembl3955376, Dtxsid00679952

Molecular Formula

C₇H₁₀O₄

Molecular Weight

158.15 g/mol

InChI Key

LQEIOPTZKCKTPQ-CNGBTNQNSA-N

1 2D Structure

CAS 501921-30-8

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

(3aS,6aR)-4-methoxy-3a,4,6,6a-tetrahydro-3H-furo[2,3-c]furan-2-one

2.1.2 InChI

InChI=1S/C7H10O4/c1-9-7-4-2-6(8)11-5(4)3-10-7/h4-5,7H,2-3H2,1H3/t4-,5-,7?/m0/s1

2.1.3 InChI Key

LQEIOPTZKCKTPQ-CNGBTNQNSA-N

2.1.4 Canonical SMILES

COC1C2CC(=O)OC2CO1

2.1.5 Isomeric SMILES

COC1[C@H]2CC(=O)O[C@H]2CO1

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 501921-30-8

2. (3as,6ar)-4-methoxy-3a,4,6,6a-tetrahydro-3h-furo[2,3-c]furan-2-one

3. (3as,6ar)-tetrahydro-4-methoxyfuro[3,4-b]furan-2(3h)-one

4. Tetrahydro-4-methoxyfuro[3,4-b]furan-2(3h)-one

5. Schembl3955376

6. Dtxsid00679952

7. Amy40424

8. Akos006303361

9. Ac-27050

10. C15871

2.3 Create Date

2011-05-17

3 Chemical and Physical Properties

Molecular Formula	C₇H₁₀O₄
Molecular Weight	158.15 g/mol
XLogP3	-0.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	158.05790880 g/mol
Monoisotopic Mass	158.05790880 g/mol
Topological Polar Surface Area	44.8 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	179
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	1

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USV offers custom peptide synthesis ranging from gram to multi-gram to multi-kilogram quantities.

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CAS Number

61535-47-5

End Use API

Darunavir

About the Company

USV is a leading health care company with focus on Active Pharmaceutical Ingredients (marketed globally w...

USV is a leading health care company with focus on Active Pharmaceutical Ingredients (marketed globally with emphasis on regulated markets of USA, European Union and Japan), Branded Generics and Bio-therapeutics. USV also specializes in Research and Development in Biotechnology, Drug Delivery and Chemistry.31 APIs are currently on offer, 13 are in advanced stages of development and 14 are under development. Segments covered include Diabetes, Cardiology, CNS, Oncology, Dermatology and Ophthalmology.