Sorbic acid - Ph.Eur. , CAS No.110-44-1

CAS: 110-44-1 Cat. No.: S431431 Summenformel: C6H8O2 Molekulargewicht: 112.13 Beilstein Registry Number: 1098547 EG-Nummer: 203-768-7
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QUALITÄT & REINHEIT Ph.Eur. ? European Pharmacopoeia grade — conforms to Ph.Eur. monographs across EU member states. Use for pharmaceutical work needing European compendial compliance.
Synonyms
(2-butenylidene) acetic acid | CHEBI:35962 | E-sorbic acid | SCHEMBL1647 | trans-trans-2,4-Hexadienoic acid | DTXSID3021277 | trans,trans-2,4-Hexadienoic acid | alpha-trans-gamma-trans-Sorbic acid | s4983 | SORBIC ACID [HSDB] | trans,trans-SA | (2E,4E)-2,
Storage
Room temperature
★
Größe
Deutschland (EU)
USA*
Preis
Menge
100g
S431431-100g
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153,50€

179,54€
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Übersicht

General Description

Sorbic acid is an organic acid. It is weakly acidic in nature. Its permeability through an edible film made of methylcellulose and palmitic acid has been evaluated.


Application

Sorbic acid may be employed as a starting reagent for the synthesis of p -toluic acid and alkyl- p -toluates.

Spezifikationen

Synonyme
(2-butenylidene) acetic acid | CHEBI:35962 | E-sorbic acid | SCHEMBL1647 | trans-trans-2,4-Hexadienoic acid | DTXSID3021277 | trans,trans-2,4-Hexadienoic acid | alpha-trans-gamma-trans-Sorbic acid | s4983 | SORBIC ACID [HSDB] | trans,trans-SA | (2E,4E)-2,
Spezifikationen & Reinheit
Ph.Eur.
Storage
Room temperature
Note
Ph.Eur.
Namen und Kennungen
Kanonisches Lächeln
CC=CC=CC(=O)O
IUPAC Name
(2E,4E)-hexa-2,4-dienoic acid
InChIKey
WSWCOQWTEOXDQX-MQQKCMAXSA-N
INCHI
1S/C6H8O2/c1-2-3-4-5-6(7)8/h2-5H,1H3,(H,7,8)/b3-2+,5-4+
Isomere SMILES
C/C=C/C=C/C(=O)O
WGK Deutschland
1
RTECS
WG2100000
Molekulargewicht
112.13
Beilstein
1098547
Reaxy-Rn
1741831
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1741831&ln=

Erweiterte Daten

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassLipids and lipid-like molecules
KlasseFatty Acyls
SubclassFatty acids and conjugates
Intermediate Tree Nodes Not available
Direct ParentMedium-chain fatty acids
Alternative Parents Unsaturated fatty acids  Straight chain fatty acids  Monocarboxylic acids and derivatives  Carboxylic acids  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic acyclic compounds
Substituents Medium-chain fatty acid - Unsaturated fatty acid - Straight chain fatty acid - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
BeschreibungThis compound belongs to the class of organic compounds known as medium-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 4 and 12 carbon atoms.
External Descriptors Unsaturated fatty acids
3D-Struktur
Interaktives chemisches Strukturmodell





Zugehörige Ziele (menschlich)
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GMNN Tbio Geminin (128009 Activities)
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Zugehörige Ziele (nicht menschlich)
Hdac6 Histone deacetylase 6 (222 Activities)
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HD1 Histone deacetylase (38 Activities)
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Pseudomonas aeruginosa (123386 Activities)
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Staphylococcus aureus (210822 Activities)
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Staphylococcus epidermidis (22802 Activities)
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Escherichia coli (133304 Activities)
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Enterococcus hirae (484 Activities)
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Aspergillus niger (16508 Activities)
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Bacillus subtilis (32866 Activities)
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Saccharomyces cerevisiae (19171 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Zygosaccharomyces bailii (36 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Candida albicans (78123 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mus musculus (284745 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
GCN5 Histone acetyltransferase GCN5 (89 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
TGR Thioredoxin glutathione reductase (28579 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Wirkungsmechanismen
Zertifikate (CoA, COO, BSE/TSE und Analyse-Diagramm)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemische und physikalische Eigenschaften
Flammpunkt (°C)127°C
Siedepunkt (°C)228℃
Schmelzpunkt (°C)132-135°C
Molekulargewicht112.130 g/mol
XLogP31.300
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass112.052 Da
Monoisotopic Mass112.052 Da
Topological Polar Surface Area37.300 Ų
Heavy Atom Count8
Formal Charge0
Complexity122.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds2
Covalently-Bonded Unit Count1
FAQs und Artikel
Citations of This Product
Lösungsrechner
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