Calamine

Synopsis, Chemistry

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Also known as: 8011-96-9, Zinc;iron(3+);oxygen(2-), Calamine lotion, Calamine [usp:jan], Tenderwrap, Medipack

Molecular Formula

Fe₂O₄Zn

Molecular Weight

241.1 g/mol

InChI Key

CPYIZQLXMGRKSW-UHFFFAOYSA-N

1 2D Structure

Calamine

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

zinc;iron(3+);oxygen(2-)

2.1.2 InChI

InChI=1S/2Fe.4O.Zn/q2*+3;4*-2;+2

2.1.3 InChI Key

CPYIZQLXMGRKSW-UHFFFAOYSA-N

2.1.4 Canonical SMILES

[O-2].[O-2].[O-2].[O-2].[Fe+3].[Fe+3].[Zn+2]

2.2 Synonyms

2.2.1 MeSH Synonyms

1. Calamine (pharmaceutical Preparation)

2.2.2 Depositor-Supplied Synonyms

1. 8011-96-9

2. Zinc;iron(3+);oxygen(2-)

3. Calamine Lotion

4. Calamine [usp:jan]

5. Tenderwrap

6. Medipack

7. Reliamed

8. Primer

9. Repara

10. Calamine (pharmaceutical Preparation)

11. Dtxsid9051612

12. Ft-0657528

13. Iron Oxide (fe2o3), Mixture With Zinc Oxide

2.3 Create Date

2007-12-05

3 Chemical and Physical Properties

Molecular Formula	Fe₂O₄Zn
Molecular Weight	241.1 g/mol
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Exact Mass	239.778671 g/mol
Monoisotopic Mass	239.778671 g/mol
Topological Polar Surface Area	4 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	0
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	7