Thiobenzoic Acid - ≥93%(T) , CAS No.98-91-9

CAS: 98-91-9 Cat. No.: T161810 Summenformel: C7H6OS Molekulargewicht: 138.18 Beilstein Registry Number: 2039640 EG-Nummer: 202-712-9 PubChem CID: 7414
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QUALITÄT & REINHEIT ≥93%(T)
Synonyms
benzenecarbothioc acid | EINECS 202-712-9 | Benzenecarbothioic S-acid | Benzoyl thiol | Q27279013 | D78412 | Benzenecarbothioic acid | monothiolbenzoic acid | BDBM50366037 | Thiobenzoicacid | NSC66502 | NSC-66502 | SCHEMBL37017 | Thiobenzoesaure | CCRIS 8
Storage
Store at 2-8°C,Argon charged
Shipped In
Wet ice
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Größe
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Preis
Menge
5g
T161810-5g
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4 Auf Lager
9,46€
25g
T161810-25g
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2 Auf Lager
18,14€
100g
T161810-100g
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1 Auf Lager
48,51€
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Warum diese Qualität

≥93%(T) für empfindliche chromatographische und analytische Workflows, die minimale Basislinieninterferenzen erfordern.

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Lagerung & Versand

Store at 2-8°C,Argon charged Versand Wet ice. Genaue Spezifikationen finden Sie im chargenspezifischen COA.

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Qualitätsdokumente

SDS, COA, Datenblatt und Spezifikationsblatt stehen zum Download bereit. Chargenspezifische COA über Chargennummernsuche abrufbar.

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Literaturbeleg

In 2 peer-reviewten Publikationen zu Chromatographie, organischer Synthese und Kreuzkupplungsreaktionen zitiert.

Übersicht

Product Application:

Thiobenzoic acid is an important organic intermediate. It can be used in agrochemical, pharmaceutical and dyestuff field.

Spezifikationen

Synonyme
benzenecarbothioc acid | EINECS 202-712-9 | Benzenecarbothioic S-acid | Benzoyl thiol | Q27279013 | D78412 | Benzenecarbothioic acid | monothiolbenzoic acid | BDBM50366037 | Thiobenzoicacid | NSC66502 | NSC-66502 | SCHEMBL37017 | Thiobenzoesaure | CCRIS 8
Spezifikationen & Reinheit
≥93%(T)
Storage
Store at 2-8°C,Argon charged
Verschickt in
Wet ice
Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.
Reinheit
≥93%(T)
Namen und Kennungen
Pubchem Sid
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488180416
Kanonisches Lächeln
C1=CC=C(C=C1)C(=O)S
IUPAC Name
benzenecarbothioic S-acid
InChIKey
UIJGNTRUPZPVNG-UHFFFAOYSA-N
INCHI
1S/C7H6OS/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)
Isomere SMILES
C1=CC=C(C=C1)C(=O)S
WGK Deutschland
3
RTECS
DH6839000
PubChem CID
7414
Molekulargewicht
138.18
Beilstein
2039640
Reaxy-Rn
1071790

Dokumentation

📋 Sicherheitsdatenblatt (SDS)

Umfassendes Dokument zu Gefahren, Handhabung, Lagerung und Einhaltung regulatorischer Vorschriften.

<<<<<<< HEAD SDS herunterladen → ======= SDS herunterladen → >>>>>>> release248-p3

✅ Analysezertifikat (COA)

Chargenspezifische Qualitätsdaten. Geben Sie Ihre Chargennummer ein, um das genaue COA abzurufen.

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📊 Datenblatt

Kurzübersicht über Produktspezifikationen und Anwendungen.

Datenblatt ansehen →

🔬 Spezifikationsblatt

Vollständige Qualitätsmerkmale und Akzeptanzkriterien für diese Qualität.

Spezifikationsblatt ansehen →

Erweiterte Daten

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
KlasseBenzene and substituted derivatives
SubclassBenzoic acids and derivatives
Intermediate Tree Nodes Not available
Direct ParentBenzoic acids and derivatives
Alternative Parents Thiobenzoic acids and derivatives  Benzoyl derivatives  Carbothioic S-acids  Carbodithioic acids  Thiocarboxylic acids and derivatives  Carboxylic acids and derivatives  Alkylthiols  Organooxygen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Thiobenzoic acid or derivatives - Benzoic acid or derivatives - Benzoyl - Carbothioic s-acid - Carbodithioic acid - Thiocarboxylic acid or derivatives - Carboxylic acid derivative - Alkylthiol - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Aromatic homomonocyclic compound
BeschreibungThis compound belongs to the class of organic compounds known as benzoic acids and derivatives. These are organic compounds containing a carboxylic acid substituent attached to a benzene ring.
External Descriptors Not available
3D-Struktur
Interaktives chemisches Strukturmodell





Zugehörige Ziele (menschlich)
CA2 Tclin Carbonic anhydrase II (17698 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CA3 Tclin Carbonic anhydrase III (753 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CA6 Tclin Carbonic anhydrase VI (993 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CA1 Tclin Carbonic anhydrase I (13240 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CA5B Tclin Carbonic anhydrase VB (957 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CA5A Tclin Carbonic anhydrase VA (1168 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CA14 Tclin Carbonic anhydrase XIV (1305 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CA12 Tclin Carbonic anhydrase XII (6231 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Zugehörige Ziele (nicht menschlich)
Ca7 Carbonic anhydrase VII (3 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Ca13 Carbonic anhydrase XIII (322 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CA4 Carbonic anhydrase IV (1713 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:

Find and download the COA for your product by matching the lot number on the packaging.

21 results found

Lot NumberCertificate TypeDatumArtikel
D2617040D2617040Certificate of AnalysisApr 24, 2026 T161810
K2418446K2418446Certificate of AnalysisNov 08, 2024 T161810
K2418448K2418448Certificate of AnalysisNov 08, 2024 T161810
K2418447K2418447Certificate of AnalysisNov 08, 2024 T161810
K2418445K2418445Certificate of AnalysisNov 08, 2024 T161810
H2627112H2627112Certificate of AnalysisNov 08, 2024 T161810
H2625060H2625060Certificate of AnalysisNov 08, 2024 T161810
I2306776I2306776Certificate of AnalysisAug 18, 2023 T161810
I2306777I2306777Certificate of AnalysisAug 18, 2023 T161810
B2419176B2419176Certificate of AnalysisAug 18, 2023 T161810
G2321310G2321310Certificate of AnalysisMay 24, 2023 T161810
G2321320G2321320Certificate of AnalysisMay 24, 2023 T161810
G2321325G2321325Certificate of AnalysisMay 24, 2023 T161810
G2321340G2321340Certificate of AnalysisMay 24, 2023 T161810
G2321371G2321371Certificate of AnalysisMay 24, 2023 T161810
G2227214G2227214Certificate of AnalysisJul 04, 2022 T161810
G2227211G2227211Certificate of AnalysisJul 04, 2022 T161810
E2305062E2305062Certificate of AnalysisJul 04, 2022 T161810
F2217237F2217237Certificate of AnalysisJun 21, 2022 T161810
E2231306E2231306Certificate of AnalysisMar 23, 2022 T161810
E2231284E2231284Certificate of AnalysisMar 23, 2022 T161810
Chemische und physikalische Eigenschaften
LöslichkeitInsoluble in water,soluble in ethanol and ether.
EmpfindlichkeitAir & Heat Sensitive
Brechungsindex1.60
Flammpunkt (°C)94 °C
Siedepunkt (°C)87 °C/10 mmHg
Schmelzpunkt (°C)20 °C
Molekulargewicht138.190 g/mol
XLogP32.400
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass138.014 Da
Monoisotopic Mass138.014 Da
Topological Polar Surface Area18.100 Ų
Heavy Atom Count9
Formal Charge0
Complexity105.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Citations of This Product
Lösungsrechner
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