Tributyl(ethyl)phosphonium Diethyl Phosphate

Catalog Number

ACM20445947-1

CAS

20445-94-7

Synonyms

Ethyltributylphosphonium diethylphosphate

IUPAC Name

Diethyl phosphate;tributyl(ethyl)phosphanium

Molecular Weight

384.48

Molecular Formula

C18H42O4P2

Canonical SMILES

CCCC[P+](CC)(CCCC)CCCC.CCOP(=O)([O-])OCC

InChI

InChI=1S/C14H32P.C4H11O4P/c1-5-9-12-15(8-4,13-10-6-2)14-11-7-3;1-3-7-9(5,6)8-4-2/h5-14H2,1-4H3;3-4H2,1-2H3,(H,5,6)/q+1;/p-1

InChI Key

RDCTYOLAEUHRGG-UHFFFAOYSA-M

Purity

96%+

Appearance

Colorless to pale-yellow liquid

Storage

-4 °C

Complexity

204

Covalently-Bonded Unit Count

2

Exact Mass

384.25583381

Hazard Statements

H315 : Causes skin irritation.H319 : Causes serious eye irritation.

Heavy Atom Count

24

MDL Number

MFCD17018975

Monoisotopic Mass

384.25583381

Precautionary Statements

P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.

REAXYS Number

15762313

Refractive Index

1.4690 to 1.4730

Topological Polar Surface Area

58.6 Ų

• Catalog Number: ACM20445947-1
• CAS: 20445-94-7
• Synonyms: Ethyltributylphosphonium diethylphosphate
• IUPAC Name: Diethyl phosphate;tributyl(ethyl)phosphanium
• Molecular Weight: 384.48
• Molecular Formula: C18H42O4P2
• Canonical SMILES: CCCC[P+](CC)(CCCC)CCCC.CCOP(=O)([O-])OCC
• InChI: InChI=1S/C14H32P.C4H11O4P/c1-5-9-12-15(8-4,13-10-6-2)14-11-7-3;1-3-7-9(5,6)8-4-2/h5-14H2,1-4H3;3-4H2,1-2H3,(H,5,6)/q+1;/p-1
• InChI Key: RDCTYOLAEUHRGG-UHFFFAOYSA-M
• Purity: 96%+
• Appearance: Colorless to pale-yellow liquid
• Storage: -4 °C
• Complexity: 204
• Covalently-Bonded Unit Count: 2
• Exact Mass: 384.25583381
• Hazard Statements: H315 : Causes skin irritation.H319 : Causes serious eye irritation.
• Heavy Atom Count: 24
• MDL Number: MFCD17018975
• Monoisotopic Mass: 384.25583381
• Precautionary Statements: P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.
• REAXYS Number: 15762313
• Refractive Index: 1.4690 to 1.4730
• Topological Polar Surface Area: 58.6 Ų