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CAS 145328-03-6
Also known as: 145328-03-6, M7pn3qau68, Dimethyl 3-(2-methylpropyl)pentanedioate, 1,5-dimethyl 3-(2-methylpropyl)pentanedioate, Pentanedioic acid, 3-(2-methylpropyl)-, dimethyl ester, Unii-m7pn3qau68
Molecular Formula
C11H20O4
Molecular Weight
216.27  g/mol
InChI Key
ODBRTAKEAMTPKE-UHFFFAOYSA-N
FDA UNII
M7PN3QAU68

1 2D Structure

CAS 145328-03-6

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
dimethyl 3-(2-methylpropyl)pentanedioate
2.1.2 InChI
InChI=1S/C11H20O4/c1-8(2)5-9(6-10(12)14-3)7-11(13)15-4/h8-9H,5-7H2,1-4H3
2.1.3 InChI Key
ODBRTAKEAMTPKE-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC(C)CC(CC(=O)OC)CC(=O)OC
2.2 Other Identifiers
2.2.1 UNII
M7PN3QAU68
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 145328-03-6

2. M7pn3qau68

3. Dimethyl 3-(2-methylpropyl)pentanedioate

4. 1,5-dimethyl 3-(2-methylpropyl)pentanedioate

5. Pentanedioic Acid, 3-(2-methylpropyl)-, Dimethyl Ester

6. Unii-m7pn3qau68

7. Schembl4880767

8. 3-isobutylglutaric Acid Dimethyl Ester

9. Db-114336

10. D92809

2.4 Create Date
2007-02-09
3 Chemical and Physical Properties
Molecular Weight 216.27 g/mol
Molecular Formula C11H20O4
XLogP32
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Exact Mass216.13615911 g/mol
Monoisotopic Mass216.13615911 g/mol
Topological Polar Surface Area52.6 Ų
Heavy Atom Count15
Formal Charge0
Complexity193
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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Elixir Pharma is founded in Sep 2009 by a group of seasoned, experienced techno commercial professionals ...
Elixir Pharma is founded in Sep 2009 by a group of seasoned, experienced techno commercial professionals in Ahmadabad, Gujarat (India). Elixir Pharma aspires to emerge as a leading Fine Chemicals, Intermediates, APIs & Chemistry Services provider to Global Life Science Companies so as to enable them in bringing innovative products to markets in the most effective & efficient manner in terms of cost, quality & time. With experienced team of scientists & engineers; GLP compliant labs and WHO GMP manufacturing plants in Ahmadabad, Elixir Pharma is suitably placed to quickly supply quality products APIs and Intermediates.
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Elixir Pharma is founded in Sep 2009 by a group of seasoned, experienced techno commercial professionals ...
Elixir Pharma is founded in Sep 2009 by a group of seasoned, experienced techno commercial professionals in Ahmadabad, Gujarat (India). Elixir Pharma aspires to emerge as a leading Fine Chemicals, Intermediates, APIs & Chemistry Services provider to Global Life Science Companies so as to enable them in bringing innovative products to markets in the most effective & efficient manner in terms of cost, quality & time. With experienced team of scientists & engineers; GLP compliant labs and WHO GMP manufacturing plants in Ahmadabad, Elixir Pharma is suitably placed to quickly supply quality products APIs and Intermediates.
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Elixir Pharma is founded in Sep 2009 by a group of seasoned, experienced techno commercial professionals ...
Elixir Pharma is founded in Sep 2009 by a group of seasoned, experienced techno commercial professionals in Ahmadabad, Gujarat (India). Elixir Pharma aspires to emerge as a leading Fine Chemicals, Intermediates, APIs & Chemistry Services provider to Global Life Science Companies so as to enable them in bringing innovative products to markets in the most effective & efficient manner in terms of cost, quality & time. With experienced team of scientists & engineers; GLP compliant labs and WHO GMP manufacturing plants in Ahmadabad, Elixir Pharma is suitably placed to quickly supply quality products APIs and Intermediates.
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