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Also known as: 52671-64-4, 4-amino-3-chlorophenol hcl, 4-amino-3-chlorophenol;hydrochloride, 2-chloro-4-hydroxyaniline hydrochloride, Mfcd00143110, Phenol, 4-amino-3-chloro-, hydrochloride
Molecular Formula
C6H7Cl2NO
Molecular Weight
180.03  g/mol
InChI Key
RFJVQGMBFQGZPV-UHFFFAOYSA-N

52671-64-4
1 2D Structure

52671-64-4

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
4-amino-3-chlorophenol;hydrochloride
2.1.2 InChI
InChI=1S/C6H6ClNO.ClH/c7-5-3-4(9)1-2-6(5)8;/h1-3,9H,8H2;1H
2.1.3 InChI Key
RFJVQGMBFQGZPV-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC(=C(C=C1O)Cl)N.Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 52671-64-4

2. 4-amino-3-chlorophenol Hcl

3. 4-amino-3-chlorophenol;hydrochloride

4. 2-chloro-4-hydroxyaniline Hydrochloride

5. Mfcd00143110

6. Phenol, 4-amino-3-chloro-, Hydrochloride

7. 4-amino-3-chlorophenolhydrochloride

8. Phenol, 4-amino-3-chloro-, Hydrochloride (1:1)

9. Schembl249529

10. Dtxsid80503908

11. Act06778

12. Bcp11294

13. 3-chloro-4-aminophenol Hydrochloride

14. Am1053

15. 4-amino-3-chloro-phenol Hydrochloride

16. Akos015888229

17. Ac-9465

18. Cs-w017237

19. 2-chloro-4-hydroxy-aniline Hydrochloride

20. 4-azanyl-3-chloranyl-phenol Hydrochloride

21. Sy013879

22. Ts-02509

23. 4-amino-3-chlorophenol Hydrochloride, 98%

24. A1376

25. Ft-0617493

26. 4-amino-3-chlorophenol--hydrogen Chloride (1/1)

27. A829194

28. A851391

29. 4-amino-3-chlorophenol Hcl;2-chloro-4-hydroxyaniline Hydrochloride;3-chloro-4-aminophenol Hydrochloride

2.3 Create Date
2007-02-08
3 Chemical and Physical Properties
Molecular Weight 180.03 g/mol
Molecular Formula C6H7Cl2NO
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass178.9904692 g/mol
Monoisotopic Mass178.9904692 g/mol
Topological Polar Surface Area46.2 Ų
Heavy Atom Count10
Formal Charge0
Complexity99.1
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2

BUILDING BLOCK

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