2-Ethylhexyl phosphate

C8H21O5PCAS 12645-31-7228.22 g/mol

Open in Covalent MOL file
OHOPOHOHHO
AlcoholPhosphate

Properties

Molecular formula
C8H21O5P
Molar mass
228.22 g/mol
Exact mass
228.1127 Da
logP
1.27Crippen estimate
Polar surface area
98.0 Ų
H-bond donors / acceptors
4 / 2
Rotatable bonds
5

Hazards

Danger
Corrosive (GHS05)Irritant (GHS07)

Aggregated from 1,202 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P264+P265, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P363, P405, P501

Identifiers

CAS number
12645-31-7
SMILES
CCCCC(CC)CO.O=P(O)(O)O
InChIKey
FZQYZMODYSBPES-UHFFFAOYSA-N
InChI
InChI=1S/C8H18O.H3O4P/c1-3-5-6-8(4-2)7-9;1-5(2,3)4/h8-9H,3-7H2,1-2H3;(H3,1,2,3,4)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

15 names · show all
  • Phosphoric acid, 2-ethylhexyl ester
  • 2-Ethylhexyl acid phosphate
  • 2EHAPO4
  • Phoslex A 8
  • Beycostat A 081
  • Hordaphos MDAH
  • JP 508
  • Sipophos 2EHP
  • AP 8
  • AP 8 (phosphate)
  • Maphos 10T
  • Servoxyl VPTZ 100
  • Hostaphat MDAH
  • Servoxyl VPDZ 100
  • 2-Ethylhexyl phosphate (mixed isomers)

Work with 2-Ethylhexyl phosphate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

2-Ethylhexanol104-76-7Parent compound

Similar compounds

2-Ethylhexyl titanate1070-10-666 % similar 2-N-Butylpropane-1,3-diol2612-26-257 % similar Di-(2-ethylhexyl)phosphoric acid298-07-753 % similar Ethylhexylglycerin70445-33-950 % similar 2-Ethylhexyl (2-ethylhexyl)phosphonate14802-03-049 % similar Tris(2-ethylhexyl) phosphate78-42-249 % similar 2-Hexyl-1-decanol2425-77-648 % similar Octyldodecanol5333-42-648 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook