Desvenlafaxine Fumarate

Synopsis, Chemistry

APIs // Active Pharmaceutical Ingredients

4 API Suppliers, 2 USDMF, 2 Listed Suppliers

DOSSIERs // Finished Dosage Formulations

4 Dossiers, 4 FDA Orange Book

DRUG PRODUCT COMPOSITION

TABLET, EXTENDED RELEASE;ORAL - EQ 100MG BASE, TABLET, EXTENDED RELEASE;ORAL - EQ 50MG BASE

TABLET, EXTENDED RELEASE;ORAL - EQ 100MG BASE
TABLET, EXTENDED RELEASE;ORAL - EQ 50MG BASE

ANALYTICAL SOLUTION(s)

1 Other Ref. Standards

1 Other Ref. Standards

Product Search

API SUPPLIERS

API Suppliers

US DMFs Filed

CEP/COS Certifications

JDMFs Filed

Other Certificates

Other Suppliers

API REF. PRICE (USD / KG)

API Market Place

INTERMEDIATES

DOSSIERS // FDF

USA (Orange Book)

Europe

Canada

Australia

South Africa

Uploaded Dossiers

GLOBAL SALES (USD Million)

U.S. Medicaid

Annual Reports

FDF Market Place

EXCIPIENTS

PATENTS & EXCLUSIVITIES

USFDA Orange Book Patents

USFDA Exclusivities

DIGITAL CONTENT

Blog #PharmaFlow

News

REF STANDARD

EDQM

USP

Other Listed Suppliers

SERVICES

Also known as: O-desmethylvenlafaxine fumarate, 93414-04-1, Atx24e9m6l, (e)-but-2-enedioic acid;4-[2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl]phenol, Phenol, 4-(2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl)-, (e)-2-butenedioate (1:1) (salt), Phenol, 4-(2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl)-, (2e)-2-butenedioate (1:1) (salt)

Molecular Formula

C₂₀H₂₉NO₆

Molecular Weight

379.4 g/mol

InChI Key

SQTJDJZCPOSWSC-WLHGVMLRSA-N

FDA UNII

ATX24E9M6L

1 2D Structure

Desvenlafaxine Fumarate

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

(E)-but-2-enedioic acid;4-[2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl]phenol

2.1.2 InChI

InChI=1S/C16H25NO2.C4H4O4/c1-17(2)12-15(13-6-8-14(18)9-7-13)16(19)10-4-3-5-11-16;5-3(6)1-2-4(7)8/h6-9,15,18-19H,3-5,10-12H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

2.1.3 InChI Key

SQTJDJZCPOSWSC-WLHGVMLRSA-N

2.1.4 Canonical SMILES

CN(C)CC(C1=CC=C(C=C1)O)C2(CCCCC2)O.C(=CC(=O)O)C(=O)O

2.1.5 Isomeric SMILES

CN(C)CC(C1=CC=C(C=C1)O)C2(CCCCC2)O.C(=C/C(=O)O)\C(=O)O

2.2 Other Identifiers

2.2.1 UNII

ATX24E9M6L

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. O-desmethylvenlafaxine Fumarate

2. 93414-04-1

3. Atx24e9m6l

4. (e)-but-2-enedioic Acid;4-[2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl]phenol

5. Phenol, 4-(2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl)-, (e)-2-butenedioate (1:1) (salt)

6. Phenol, 4-(2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl)-, (2e)-2-butenedioate (1:1) (salt)

7. Unii-atx24e9m6l

8. Schembl521350

9. Schembl3400998

10. Dtxsid901027852

11. Desvenlafaxine Fumarate [usp-rs]

12. Desvenlafaxine Fumarate [who-dd]

13. Desvenlafaxine Fumarate [orange Book]

14. Desvenlafaxine Fumarate Anhydrous [mi]

15. Desvenlafaxine Fumarate [usp Monograph]

16. Q27274120

17. Phenol, 4-(2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl)-, (2z)-2-butenedioate (1:1)

2.4 Create Date

2007-02-08

3 Chemical and Physical Properties

Molecular Formula	C₂₀H₂₉NO₆
Molecular Weight	379.4 g/mol
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	6
Exact Mass	379.19948764 g/mol
Monoisotopic Mass	379.19948764 g/mol
Topological Polar Surface Area	118 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	385
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2