Grundinformationen
- CAS
59-85-8- Standard-SMILES
O=C(O)c1cc[c]([Hg][Cl])cc1- InChIKey
YFZOUMNUDGGHIW-UHFFFAOYSA-M- Summenformel
- C7H4ClHgO2.H
- Durchschnittliche Molmasse
- 357,16 g/mol
- Monoisotopische Masse
- 357,968451
Überblick
P-chloromercuribenzoic acid is a chlorine molecular entity and a mercuribenzoic acid. It is functionally related to a benzoic acid.
Namen und Bezeichner
- Bevorzugter Name
- p-(Chloromercuri)benzoic acid
- IUPAC
- (4-carboxyphenyl)-chloromercury
- Lokaler Name
- 4-Chlormercuriobenzoesure
- Englischer Name
- 4-Chloromercuribenzoic acid
- Summenformel
- C7H5ClHgO2
- Molmasse
- 357.16
Namen und Synonyme
p-Chloromercuribenzoic acid59-85-8(4-Carboxyphenyl)chloromercury4-Carboxyphenylmercuric chlorideP-(CHLOROMERCURI)BENZOIC ACIDMercurate(1-), (4-carboxylatophenyl)chloro-, hydrogenCHEBI:28420NSC-32866p Chloromercuribenzoic Acid4 Chloromercuribenzoic AcidAcid, p-ChloromercuribenzoicAcid, 4-Chloromercuribenzoic
Weitere Namen anzeigen
DYRP-CMBP-CMBADHFRP1usafd-3NSC 32866DHFR from mousep-Chlormercuribenzoic Acid
RefChem:858027200-442-6(4-Carboxylatophenyl)chloromercurate(1-), hydrogenChloromercuribenzoateChloromercuribenzoic acidE1LE0WZ4BO4-chloromercuribenzoic acidPCMB
Datenbank-Bezeichner
- CAS
59-85-8- PubChem CID
- 1730
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 37,3 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 11
- Formalladung
- 0
- Komplexität
- 143
Experimentelle und physikochemische Eigenschaften
Chemical ClassesMetals -> Metals, Organic Compounds
Vapor Pressure0.0000148 [mmHg]
Physical DescriptionInsoluble in water (303 mg/L at 25 deg C); [ChemIDplus] White solid; Slightly soluble in water; [Alfa Aesar MSDS]
Collision Cross Section143.0 Ų [M-H]- [CCS Type: DT; Buffer gas: N2; Ionization: ESI-; Dataset: TOXCAST; Source Identifier: DTXSID8040725]
Physikochemische Eigenschaften
- Schmelzpunkt
- 287 °C · 287 °C (dec.)(lit.)
- storage temp.
- -20 °C · -20°C Freezer
- Löslichkeit
- Aqueous Base (Slightly, Heated),
- Aggregatzustand
- solid
- Farbe
- White
- Biologische Quelle
- mouse
- BRN
- 3662892 · 3662892
- InChI
- 1S/C7H5O2.ClH.Hg/c8-7(9)6-4-2-1-3-5-6;;/h2-5H,(H,8,9);1H;/q;;+1/p-1
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Danger
H300 (100%): Fatal if swallowed [Danger Acute toxicity, oral]
P260, P262, P264, P270, P271, P273, P280, P284, P301+P316, P302+P352, P304+P340, P316, P319, P320, P321, P330, P361+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Chemical: Mercurate(1-), (4-carboxylatophenyl)chloro-, hydrogen
4-Chloromercuribenzoic acid: HSNO Approval: HSR006174 Approved with controls
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazards SummaryIntraperitoneal LD50 (mouse) = 25 mg/kg; [RTECS] Likely to be highly toxic by ingestion, inhalation, and skin absorption; [Alfa Aesar MSDS] See Mercury, aryl compounds and linked occupational diseases.
Hazard Classes and CategoriesAcute Tox. 2 (100%)
Sicherheit und Schutzausrüstung
Threshold Limit Values (TLV)0.1 [mg/m3], as Hg
Permissible Exposure Limit (PEL)0.1 [mg/m3], as Hg
Chemie und Industrie
Pharmakologische Informationen
MeSH Pharmacological ClassificationChemical agents that react with SH groups. This is a chemically diverse group that is used for a variety of purposes. Among these are enzyme inhibition, enzyme reactivation or protection, and labelling.
Verwendung und Herstellung
UsesAn organic mercurial used as a sulfhydryl reagent. [ChemIDplus]
General Manufacturing InformationMercurate(1-), (4-carboxylatophenyl)chloro-, hydrogen: INACTIVE
Anwendungen
Verwenden4-CHLOROMERCURIBENZOIC ACID can be used to inhibit some enzymes that require unmodified cysteine residues (e.g., adenylyl cyclase).
Anbieter16 Anbieter
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
四川库利南科技有限公司400-1166-196 18981987031 · [email protected]
艾科试剂4008-755-333 18080918076 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
北京京土恒盛化工科技有限公司00-13911456598 13911456598 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
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