Allchem Lifescience | CAS 22409-91-2 | Related Intermediates | Manufacturers & Suppliers

CAS 22409-91-2

Chemistry, 1 End Use API, 8 Related Intermediates

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Also known as: Ethyl 3-phenoxypropanoate, 22409-91-2, Nsc406928, Propanoic acid, 3-phenoxy-ethyl ester, Ethyl3-phenoxypropanoate, Schembl38664

Molecular Formula

C₁₁H₁₄O₃

Molecular Weight

194.23 g/mol

InChI Key

TXKJOPXGYSFUNC-UHFFFAOYSA-N

1 2D Structure

CAS 22409-91-2

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

ethyl 3-phenoxypropanoate

2.1.2 InChI

InChI=1S/C11H14O3/c1-2-13-11(12)8-9-14-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3

2.1.3 InChI Key

TXKJOPXGYSFUNC-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CCOC(=O)CCOC1=CC=CC=C1

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. Ethyl 3-phenoxypropanoate

2. 22409-91-2

3. Nsc406928

4. Propanoic Acid, 3-phenoxy-ethyl Ester

5. Ethyl3-phenoxypropanoate

6. Schembl38664

7. Dtxsid50324526

8. Txkjopxgysfunc-uhfffaoysa-n

9. Amy25615

10. Mfcd00026919

11. Akos007930362

12. Nsc-406928

13. Propanoic Acid, 3-phenoxy-, Ethyl Ester

14. As-58619

15. Db-045903

16. A816183

17. J-014693

2.3 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₁₁H₁₄O₃
Molecular Weight	194.23 g/mol
XLogP3	2.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	6
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	35.5
Heavy Atom Count	14
Formal Charge	0
Complexity	162
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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CAS Number

6640-24-0

End Use API

Established in 2003 with small pilot plant and came in to commercial production in 2013 in the name of Al...

Established in 2003 with small pilot plant and came in to commercial production in 2013 in the name of Allchem Laboratories, it is an independent privately owned company.Name changed from Allchem Laboratories to Allchem Lifescience Pvt. Ltd in April-2017.We are Allchem Lifescience Pvt Ltd., a fully cGMP compliant pharmaceutical intermediates plant located in the outskirts of Vadodara, Gujarat, India. (Location :400 km north of Mumbai at Vadodara, Gujarat, INDIA).

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