Grundinformationen
- CAS
4036-30-0- Standard-SMILES
O=C(O)CC(C(=O)O)c1ccccc1- InChIKey
LVFFZQQWIZURIO-UHFFFAOYSA-N- Summenformel
- C10H10O4
- Durchschnittliche Molmasse
- 194,18 g/mol
- Monoisotopische Masse
- 194,0579088
Überblick
DL-Phenylsuccinic acid has been reported in Oryza sativa with data available.
Namen und Bezeichner
- Bevorzugter Name
- Phenylsuccinic acid
- IUPAC
- 2-phenylbutanedioic acid
- Lokaler Name
- Phenylbernsteinsure
- Englischer Name
- DL-Phenylsuccinic acid
- Summenformel
- C10H10O4
- Molmasse
- 194.18
Namen und Synonyme
Phenylsuccinic acid635-51-82-phenylbutanedioic acid2-PhenylsuccinateButanedioic acid, 2-phenyl-DTXSID60883518RefChem:478242DTXCID60893410211-238-1dl-Phenylsuccinic acid2-Phenylsuccinic acidPhenyl succinic acid
Weitere Namen anzeigen
(2S)-2-phenylbutanedioateD,L-2-PHENYLBUTANEDIOIC ACIDAKOS BC-1259phenylsuccinicDL-phenylsuccinatephenysuccinic acid
Butanedioic acid, phenyl-10424-29-0Succinic acid, phenyl-PhenylsuccinateMFCD00004256alpha-Phenylsuccinic acid.alpha.-Phenylsuccinic acidP0155
Datenbank-Bezeichner
- CAS
4036-30-0、635-51-8- PubChem CID
- 95459
- DTXSID
DTXSID60883518- ChEMBL
CHEMBL76085- EC Number
- 211-238-1
- Nikkaji
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 0,9
- Polarare Oberfläche (TPSA)
- 74,6 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 14
- Formalladung
- 0
- Komplexität
- 218
Experimentelle und physikochemische Eigenschaften
Chemical ClassesIndustrial compound
Physical DescriptionCBI
Physikochemische Eigenschaften
- Schmelzpunkt
- 166 · 166-168 °C (lit.)
- Siedepunkt
- 290.62 °C · 290.62°C (rough estimate)
- Dichte
- 1.2534 · 1.2534 (rough estimate)
- Dampfdruck
- 0.001 · 0.001-0.003Pa at 25-50℃
- Brechungsindex
- 1.543 · 1.5430 (estimate)
- storage temp.
- Sealed in dry,Room Temperature
- Aggregatzustand
- Crystalline Powder
- pka
- 1 · pK1:3.78;pK2:5.55 (20°C)
- Farbe
- White cream
- BRN
- 1875051 · 1875051
- Stabilität
- Combustible. Incompatible with strong oxidizing agents.
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
This chemical does not meet GHS hazard criteria for 20% (1 of 5) of reports.
Warning
H315 (40%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 5 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Butanedioic acid, 2-phenyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Butanedioic acid, 2-phenyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Status: Active Update: 21-04-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/27571
Hazard Classes and CategoriesSkin Irrit. 2 (40%)
Sicherheitsdaten
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 29173980
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 22-24/25-37/39-26
- Speicherklasse
- 11 - Combustible Solids
Chemie und Industrie
Verwendung und Herstellung
U.S. Production2023: <50,000 lb
Consumer UsesFlux agent
Industry UsesFlux agent
General Manufacturing Information
Electrical Equipment, Appliance, and Component Manufacturing
Butanedioic acid, 2-phenyl-: ACTIVE
Anbieter100 Anbieter
国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
河北秒变生物科技有限公司17733850068
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
Wuhan EnTai Technology Development Co,.Ltd86-27-82330560 · [email protected]
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