Bis (2-ethylhexyl) phosphate

CAT: 0024-sc-239351Size: 25 gDry Ice: NoHazardous: No

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CAT#:0024-sc-239351Size:25 g

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CAS Number

298-07-7

Chemical Information

Bis(2-ethylhexyl) phosphate

Di-(2-ethylhexyl)phosphoric acid is an odorless light yellow liquid. Floats on water. (USCG, 1999)

CAS Number	298-07-7
PubChem CID	9275
IUPAC Name	bis(2-ethylhexyl) hydrogen phosphate
Molecular Formula	C16H35O4P
Molecular Weight	322.42
XLogP	5.2
Topological Polar Surface Area	55.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	14
Heavy Atom Count	21
Formal Charge	0
Complexity	259

SMILES

CCCCC(CC)COP(=O)(O)OCC(CC)CCCC

InChI

InChI=1S/C16H35O4P/c1-5-9-11-15(7-3)13-19-21(17,18)20-14-16(8-4)12-10-6-2/h15-16H,5-14H2,1-4H3,(H,17,18)

InChIKey

SEGLCEQVOFDUPX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 298-07-7

CID: 9275

Formula: C16H35O4P

MW: 322.42

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	322.42
XLogP3	5.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	14
Exact Mass	322.22729659
Monoisotopic Mass	322.22729659
Topological Polar Surface Area	55.8 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	259
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-484889	Bis (2-ethylhexyl) Ether
sc-239352	Bis (2-ethylhexyl) sebacate
sc-487364	Bis (2-ethylhexyl) Itaconate
sc-252442	Bis (2-ethylhexyl) adipate
sc-485267	Bis (2-ethylhexyl) fumarate
sc-503649	Bis (2-ethylhexyl) Azelate
sc-487230	Bis (2-ethylhexyl) Maleate
sc-252442A	Bis (2-ethylhexyl) adipate
sc-474439	Bis (2-ethylhexyl) Suberate
sc-487673	Bis (2-ethylhexyl) Dodecanedioate

Catalog	Name
HY-W008954-01	Tris (2-ethylhexyl) phosphate
BAA07003-01	Mono (2-ethylhexyl) phosphate
TRC-T884650-10G	Tris(2-ethylhexyl) Phosphate
AR-M02927-01	2-Ethylhexyl Diphenyl Phosphate
FE30030-01	Bis (2-Ethylhexyl) phosphate
TRC-B433865-5G	Bis(2-ethylhexyl) Phosphate
TRC-T884652-10MG	Tris(2-ethylhexyl) Phosphate-d51
TRC-B433867-2.5MG	Bis(2-ethylhexyl) Phosphate-d34
10092482-100g	Bis (2-ethylhexyl) hydrogen phosphate
RAA36897-01	Bis (2-ethylhexyl) phenyl phosphate