U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula 2C7H5O2.Ca
Molecular Weight 282.305
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CALCIUM BENZOATE

SMILES

[Ca++].[O-]C(=O)C1=CC=CC=C1.[O-]C(=O)C2=CC=CC=C2

InChI

InChIKey=NSQPPSOSXWOZNH-UHFFFAOYSA-L
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

HIDE SMILES / InChI
Calcium benzoate is the calcium salt of benzoic acid. Used as a preservative, both antibacterial and antifungal. Calcium benzoate can be found in concentrated pineapple juice. People who suffer from asthma, aspirin sensitivity or the skin disease urticaria may have allergic reactions and/or find their symptoms become worse following consumption of benzoic acid, particularly in combination with tartrazine (E102). Calcium benzoate (E213) is approved for use as a food additive in the EU, USA and Australia and New Zealand.

Approval Year

Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
PubMed

PubMed

TitleDatePubMed
Structure and physical stability of hydrates and thermotropic mesophase of calcium benzoate.
2006 May
Patents

Patents

Sample Use Guides

Eight barrows (Yorkshire x [Finnish Landrace x Dutch Landrace]), initially 30 kg BW, were fitted with ileal cannulas to evaluate the effects of supplementing Ca benzoate (2.4%) and organic acids (OA) in the amount of 300 mEq acid/kg feed on dietary buffering capacity (BC), apparent digestibility and retention of nutrients, and manure characteristics.
Route of Administration: Oral
In Vitro Use Guide
Unknown
Name Type Language
CALCIUM BENZOATE
FCC   INCI  
INCI  
Official Name English
CALCIUM BENZOATE [INCI]
Common Name English
CALCIUM BENZOATE [USP-RS]
Common Name English
CALCIUM BENZOATE [FCC]
Common Name English
E-213
Code English
INS-213
Code English
CALCIUM BENZOATE (E 213)
Common Name English
BENZOIC ACID, CALCIUM SALT
Common Name English
CALCIUM DIBENZOATE
Systematic Name English
MONOCALCIUM BENZOATE
Systematic Name English
INS NO.213
Code English
E213
Common Name English
BENZOCALOL
Common Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 326110
Created by admin on Fri Dec 15 14:57:52 GMT 2023 , Edited by admin on Fri Dec 15 14:57:52 GMT 2023
CODEX ALIMENTARIUS (GSFA) INS-213
Created by admin on Fri Dec 15 14:57:52 GMT 2023 , Edited by admin on Fri Dec 15 14:57:52 GMT 2023
JECFA EVALUATION INS-213
Created by admin on Fri Dec 15 14:57:52 GMT 2023 , Edited by admin on Fri Dec 15 14:57:52 GMT 2023
Code System Code Type Description
NCI_THESAURUS
C92224
Created by admin on Fri Dec 15 14:57:52 GMT 2023 , Edited by admin on Fri Dec 15 14:57:52 GMT 2023
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WIKIPEDIA
CALCIUM BENZOATE
Created by admin on Fri Dec 15 14:57:52 GMT 2023 , Edited by admin on Fri Dec 15 14:57:52 GMT 2023
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FDA UNII
3QDE968MKD
Created by admin on Fri Dec 15 14:57:52 GMT 2023 , Edited by admin on Fri Dec 15 14:57:52 GMT 2023
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ECHA (EC/EINECS)
218-235-4
Created by admin on Fri Dec 15 14:57:52 GMT 2023 , Edited by admin on Fri Dec 15 14:57:52 GMT 2023
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SMS_ID
100000170330
Created by admin on Fri Dec 15 14:57:52 GMT 2023 , Edited by admin on Fri Dec 15 14:57:52 GMT 2023
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RS_ITEM_NUM
1086378
Created by admin on Fri Dec 15 14:57:52 GMT 2023 , Edited by admin on Fri Dec 15 14:57:52 GMT 2023
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CAS
2090-05-3
Created by admin on Fri Dec 15 14:57:52 GMT 2023 , Edited by admin on Fri Dec 15 14:57:52 GMT 2023
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PUBCHEM
62425
Created by admin on Fri Dec 15 14:57:52 GMT 2023 , Edited by admin on Fri Dec 15 14:57:52 GMT 2023
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NCI_THESAURUS
C45678
Created by admin on Fri Dec 15 14:57:52 GMT 2023 , Edited by admin on Fri Dec 15 14:57:52 GMT 2023
CONCEPT Industrial Aid
EVMPD
SUB184162
Created by admin on Fri Dec 15 14:57:52 GMT 2023 , Edited by admin on Fri Dec 15 14:57:52 GMT 2023
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EPA CompTox
DTXSID4044612
Created by admin on Fri Dec 15 14:57:52 GMT 2023 , Edited by admin on Fri Dec 15 14:57:52 GMT 2023
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