CAS 124937-62-8

Chemistry, 1 End Use API, 2 Related Intermediates

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Also known as: 124937-62-8, Methyl 3-(2-methoxy-5-methylphenyl)-3-phenylpropanoate, 3-(2-methoxy-5-methylphenyl)-3-phenylpropanoic acid methyl ester, 2-methoxy-5-methyl-beta-phenylbenzenepropanoic acid methyl ester, Methyl 3-(2-methoxy-5-methyl-phenyl)-3-phenyl-propanoate, Methyl3-(2-methoxy-5-methylphenyl)-3-phenylpropionate

Molecular Formula

C₁₈H₂₀O₃

Molecular Weight

284.3 g/mol

InChI Key

BJQJPTJDNINOMT-UHFFFAOYSA-N

1 2D Structure

CAS 124937-62-8

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

methyl 3-(2-methoxy-5-methylphenyl)-3-phenylpropanoate

2.1.2 InChI

InChI=1S/C18H20O3/c1-13-9-10-17(20-2)16(11-13)15(12-18(19)21-3)14-7-5-4-6-8-14/h4-11,15H,12H2,1-3H3

2.1.3 InChI Key

BJQJPTJDNINOMT-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CC1=CC(=C(C=C1)OC)C(CC(=O)OC)C2=CC=CC=C2

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 124937-62-8

2. Methyl 3-(2-methoxy-5-methylphenyl)-3-phenylpropanoate

3. 3-(2-methoxy-5-methylphenyl)-3-phenylpropanoic Acid Methyl Ester

4. 2-methoxy-5-methyl-beta-phenylbenzenepropanoic Acid Methyl Ester

5. Methyl 3-(2-methoxy-5-methyl-phenyl)-3-phenyl-propanoate

6. Methyl3-(2-methoxy-5-methylphenyl)-3-phenylpropionate

7. Schembl2789512

8. Dtxsid20462767

9. Bcp07580

10. Akos015914490

11. Ft-0648921

12. 937m628

13. A805326

14. 2-methoxy-5-methyl-b-phenylbenzenepropanoic Acid Methyl Ester

15. Methyl (3rs)-3-(2-methoxy-5-methylphenyl)-3-phenylpropanoate

2.3 Create Date

2006-10-26

3 Chemical and Physical Properties

Molecular Formula	C₁₈H₂₀O₃
Molecular Weight	284.3 g/mol
XLogP3	3.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	6
Exact Mass	284.14124450 g/mol
Monoisotopic Mass	284.14124450 g/mol
Topological Polar Surface Area	35.5 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	322
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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Benzene propanoic acid-2-methoxy-5-methyl ? phenyl

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CAS Number

40546-94-9

End Use API

Tolterodine Tartrate

About the Company

Enal Drugs Private Limited,an ISO 9001 : 2000 certified company, specializes in developing and producing ...

Enal Drugs Private Limited,an ISO 9001 : 2000 certified company, specializes in developing and producing anti ulcerative drugs, their intermediates, other active pharmaceutical ingredients (APIs) and intermediates. The project implementation commenced in the year 1990. Experimental batches in pilot plant were undertaken and commercial production started in the year 1996. The promoters are first generation entrepreneurs with high technical qualifications, professional experience and leadership qualities team spirit and confidence to make this activity a successful business venture.

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