4CH-015527

Chemistry, 4 End Use API, 19 Related Intermediates

Manufacturers/Suppliers

4 Suppliers

4 Suppliers

Also known as: 202197-26-0, 3-chloro-4-((3-fluorobenzyl)oxy)aniline, 3-chloro-4-[(3-fluorophenyl)methoxy]aniline, 3-chloro-4-[(3-fluorobenzyl)oxy]aniline, Benzenamine, 3-chloro-4-[(3-fluorophenyl)methoxy]-, Mfcd06809822

Molecular Formula

C₁₃H₁₁ClFNO

Molecular Weight

251.68 g/mol

InChI Key

AYPFEYDGZDPAPE-UHFFFAOYSA-N

1 2D Structure

4CH-015527

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

3-chloro-4-[(3-fluorophenyl)methoxy]aniline

2.1.2 InChI

InChI=1S/C13H11ClFNO/c14-12-7-11(16)4-5-13(12)17-8-9-2-1-3-10(15)6-9/h1-7H,8,16H2

2.1.3 InChI Key

AYPFEYDGZDPAPE-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1=CC(=CC(=C1)F)COC2=C(C=C(C=C2)N)Cl

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 202197-26-0

2. 3-chloro-4-((3-fluorobenzyl)oxy)aniline

3. 3-chloro-4-[(3-fluorophenyl)methoxy]aniline

4. 3-chloro-4-[(3-fluorobenzyl)oxy]aniline

5. Benzenamine, 3-chloro-4-[(3-fluorophenyl)methoxy]-

6. Mfcd06809822

7. 4-(3-fluorobenzyloxy)-3-chlorobenzenamine

8. Ec 445-590-4

9. Schembl156718

10. Dtxsid10427603

11. Bcp10606

12. Zinc3866590

13. (non-labelled)lapatinib Impurity-d4

14. 3-chloro4-(3-fluorobenzyloxy)aniline

15. Akos008093322

16. 4-(3-fluorobenzyloxy)-3-chloroaniline

17. Ac-8505

18. Sb18202

19. 3-chloro-4(m-fluoro-benzyloxy)-aniline

20. 3-chloro-4-(3-fluoro-benzyloxy)aniline

21. 3-chloro-4-(3-fluorobenzyloxy)-aniline

22. 3-choro-4-(m-fluoro-benzyloxy)-aniline

23. 4-(3-fluorobenzyloxy)-3-chloro Aniline

24. 3-chloro-4-(m-fluoro-benzyloxy)-aniline

25. Sy008144

26. Ts-00798

27. 3-chloro-4-(3-fluorobenzyloxy)phenylamine

28. Am20060861

29. Cs-0008658

30. Ft-0659411

31. En300-31606

32. 197c260

33. A814338

34. Ar-527/43363328

35. 3-chloro-4-(3-fluorobenzyloxy)aniline, Aldrichcpr

36. Q-101356

37. 3-chloro-4-[(3-fluorophenyl)methoxy]aniline Hydrochloride;3-chloro-4-(3-fluorobenzyloxy)aniline

2.3 Create Date

2006-07-29

3 Chemical and Physical Properties

Molecular Formula	C₁₃H₁₁ClFNO
Molecular Weight	251.68 g/mol
XLogP3	3.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	251.0513198 g/mol
Monoisotopic Mass	251.0513198 g/mol
Topological Polar Surface Area	35.2 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	242
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