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Substance Name: Calcium benzoate
RN: 2090-05-3
UNII: 3QDE968MKD
InChIKey: NSQPPSOSXWOZNH-UHFFFAOYSA-L

Molecular Formula

  • C7-H6-O2.1/2Ca

Molecular Weight

  • 282.307
 
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Names and Synonyms

Results Name

  • Calcium benzoate

Name of Substance

  • Benzoic acid, calcium salt
  • Calcium benzoate

Synonyms

  • Benzoic acid, calcium salt
  • Calcium benzoate
  • Calcium dibenzoate
  • EINECS 218-235-4
  • UNII-3QDE968MKD

Systematic Names

  • Benzoic acid, calcium salt
  • Benzoic acid, calcium salt (2:1)
  • Calcium dibenzoate

Superlist Name

  • Calcium benzoate

Registry Numbers

CAS Registry Number

  • 2090-05-3

FDA UNII

  • 3QDE968MKD

System Generated Number

  • 0002090053

Molecular Formulas

Molecular Formula

  • C7-H6-O2.1/2Ca

Molecular Formula Fragments

  • C7-H6-O2
  • Ca
  • COMPONENT

Structure Descriptors

InChI

1S/2C7H6O2.Ca/c2*8-7(9)6-4-2-1-3-5-6;/h2*1-5H,(H,8,9);/q;;+2/p-2

InChIKey

NSQPPSOSXWOZNH-UHFFFAOYSA-L

Smiles

c1ccc(cc1)C(=O)[O-].c1ccc(cc1)C(=O)[O-].[Ca+2]