Diphenylhydrogenphosphat

Phosphoric acid, diphenyl ester

HCID 13282CAS 53396-64-8

Grundinformationen

Standard-SMILES
O=P(O)(Oc1ccccc1)Oc1ccccc1
InChIKey
ASMQGLCHMVWBQR-UHFFFAOYSA-N
Summenformel
C12H11O4P
Durchschnittliche Molmasse
250,19 g/mol
Monoisotopische Masse
250,03949583

Namen und Bezeichner

Bevorzugter Name
Phosphoric acid, diphenyl ester
IUPAC
diphenyl hydrogen phosphate
Lokaler Name
Diphenylhydrogenphosphat
Englischer Name
Diphenyl phosphate
Summenformel
C12H11O4P
Molmasse
250.19

Namen und Synonyme

DIPHENYL PHOSPHATEDiphenyl hydrogen phosphate838-85-7diphenylphosphatePhosphoric acid, diphenyl esterPhenyl hydrogen phosphatePhenyl phosphate ((PhO)2(HO)PO)NSC 6518EINECS 212-657-2DTXSID1048207BRN 1379164DTXCID3028182
Weitere Namen anzeigen
Diphenyl phosphate 99%Phosphoric acid diphenylBiphenyl EsterBiapenem Impurity 21DiphenylPhosphate>Diphenyl phosphate,99%Diphenyl phosphate, 97%
4-06-00-00714 (Beilstein Handbook Reference)RefChem:862590212-657-2Phosphoric acid diphenyl esterMFCD00003033diphenylphosphoric acidSitafloxacin Impurity 29CHEMBL3186576

Datenbank-Bezeichner

CAS
53396-64-8、838-85-7
PubChem CID
13282
DTXSID
DTXSID1048207
ChEMBL
CHEMBL3186576
ChEBI
CHEBI:166468
UNII
PR9H42V2X6
EC Number
212-657-2
Nikkaji
J32.756E

Eigenschaften

Berechnete Struktureigenschaften

XLogP
1,4
Polarare Oberfläche (TPSA)
55,8 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
4
Frei drehbare Bindungen
4
Schwere Atome
17

Experimentelle und physikochemische Eigenschaften

Collision Cross Section · 2 Einträge

153.6 Ų [M-H]- [CCS Type: DT; Buffer gas: N2; Ionization: ESI-; Dataset: TOXCAST; Source Identifier: DTXSID1048207];156.5 Ų [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID1048207]

164.38 Ų [M+Na]+;152.82 Ų [M-H]-;157.41 Ų [M+H]+

Physikochemische Eigenschaften

Schmelzpunkt
62 · 62-66 °C (lit.)
Siedepunkt
280 °C · 280°C
Dichte
0 · 0,76 g/cm3
Brechungsindex
1.625 · 1.6250
Flammpunkt
4 °C · 4°C
storage temp.
Inert atmosphere,Room Temperature

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

This chemical does not meet GHS hazard criteria for 42.2% (27 of 64) of reports.

Danger

H314 (54.7%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation];H318 (28.1%): Causes serious eye damage [Danger Serious eye damage/eye irritation]

P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 64 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 27 of 64 reports by companies.;There are 5 notifications provided by 37 of 64 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Regulatory Information · 4 Einträge

Chemical: Phosphoric acid, diphenyl ester

Hazard Traits - Neurotoxicity; Reproductive Toxicity;Authoritative List - CECBP - Priority Chemicals;Report - if used as a fragrance or flavor ingredient

Phosphoric acid, diphenyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Phosphoric acid, diphenyl ester 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)

Phosphoric acid, diphenyl ester: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Other Safety InformationIMAP assessments - Phosphoric acid, diphenyl ester: Human health tier I assessment;Evaluation - Triphenyl phosphate and diphenyl phosphate
Hazard Classes and CategoriesSkin Corr. 1B (54.7%);Eye Dam. 1 (28.1%)

Regulatorische Informationen

Regulatory Information · 4 Einträge

Chemical: Phosphoric acid, diphenyl ester

Hazard Traits - Neurotoxicity; Reproductive Toxicity;Authoritative List - CECBP - Priority Chemicals;Report - if used as a fragrance or flavor ingredient

Phosphoric acid, diphenyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Phosphoric acid, diphenyl ester 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)

Phosphoric acid, diphenyl ester: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Sicherheitsdaten

wgk
3
tsca
TSCA listed
hs_code
29190090
RTECS-Nr.
TC5470000
risk_code
36/37/38
safety_code
22-24/25

Chemie und Industrie

Verwendung und Herstellung

U.S. Production2023: 125,346 lb;2022: 135,567 lb;2021: 117,492 lb;2020: 117,196 lb
Consumer UsesSurfactant (surface active agent)
Industry UsesSurfactant (surface active agent)
General Manufacturing Information · 2 Einträge

Paint and Coating Manufacturing

Phosphoric acid, diphenyl ester: ACTIVE

Vor- und nachgelagerte Produkte

Nachgelagerte Produkte

Anbieter50 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]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]
河北创海生物科技有限公司+86-86-13131129325 · [email protected]

Ergänzende Hinweise

DefinitionChEBI: Diphenyl phosphate is an aryl phosphate and metabolite of the flame retardant Triphenyl Phosphate and also a metabolite of 2-Ethylhexyl diphenyl phosphate.

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