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ACTIVE PHARMA INGREDIENTS

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1 USDMF

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Chemistry

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Also known as: 5560-62-3, Xenysalate hydrochloride, Biphenamine hcl, 2-(diethylamino)ethyl 2-hydroxy-3-biphenylcarboxylate hydrochloride, Biphenamine hydrochloride [usan], 0wn4kyj0c0

Molecular Formula

C₁₉H₂₄ClNO₃

Molecular Weight

349.8 g/mol

InChI Key

IBBPBOICXYUQID-UHFFFAOYSA-N

FDA UNII

0WN4KYJ0C0

1 2D Structure

Biphenamine HCl

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-(diethylamino)ethyl 2-hydroxy-3-phenylbenzoate;hydrochloride

2.1.2 InChI

InChI=1S/C19H23NO3.ClH/c1-3-20(4-2)13-14-23-19(22)17-12-8-11-16(18(17)21)15-9-6-5-7-10-15;/h5-12,21H,3-4,13-14H2,1-2H3;1H

2.1.3 InChI Key

IBBPBOICXYUQID-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CCN(CC)CCOC(=O)C1=CC=CC(=C1O)C2=CC=CC=C2.Cl

2.2 Other Identifiers

2.2.1 UNII

0WN4KYJ0C0

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 5560-62-3

2. Xenysalate Hydrochloride

3. Biphenamine Hcl

4. 2-(diethylamino)ethyl 2-hydroxy-3-biphenylcarboxylate Hydrochloride

5. Biphenamine Hydrochloride [usan]

6. 0wn4kyj0c0

7. (1,1'-biphenyl)-3-carboxylic Acid, 2-hydroxy-, 2-(diethylamino)ethyl Ester, Hydrochloride

8. [1,1'-biphenyl]-3-carboxylic Acid, 2-hydroxy-, 2-(diethylamino)ethyl Ester, Hydrochloride

9. 2-(diethylamino)ethyl 2-hydroxy-3-biphenylcarboxylate Hcl

10. Biphenamine Hydrochloride (usan)

11. 2-(diethylamino)ethyl 2-hydroxy-3-phenylbenzoate;hydrochloride

12. (1,1'-biphenyl)-3-carboxylic Acid, 2-hydroxy-2-(diethylamino)ethyl Ester, Hydrochloride

13. Unii-0wn4kyj0c0

14. Alvinine Shampoo

15. Einecs 226-930-9

16. Xenysalatehydrochlorid

17. Schembl192932

18. Chembl2106552

19. Dtxsid0063949

20. Mfcd28388251

21. Biphenamine Hydrochloride [mi]

22. Akos030228523

23. Xenysalate Hydrochloride [mart.]

24. D03127

25. Q27231198

26. Biphenamine Hydrochloride 100 Microg/ml In Acetonitrile

27. 2-(diethylamino)ethyl2-hydroxy-3-biphenylcarboxylatehcl

28. .beta.-diethylaminoethyl-3-phenyl-2-hydroxybenzoate Hydrochloride

29. (1,1'-biphenyl)-3-carboxylic Acid, 2-hydroxy-, 2-(diethylamino)ethyl Ester, Hydrochloride (1:1)

2.4 Create Date

2005-08-08

3 Chemical and Physical Properties

Molecular Formula	C₁₉H₂₄ClNO₃
Molecular Weight	349.8 g/mol
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	8
Exact Mass	349.1444713 g/mol
Monoisotopic Mass	349.1444713 g/mol
Topological Polar Surface Area	49.8 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	351
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	2