Bis (2-ethylhexyl) succinate

CAT: 0926-CAA91557-01Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0926-CAA91557-01Size:25 mg

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CAS Number

2915-57-3

MDL Number

MFCD00127980

Smiles

CCCCC (CC) COC (=O) CCC (=O) OCC (CC) CCCC

Molecular Formula

C20H38O4

Molecular Weight

342.5 g/mol

Controlled

Chemical Information

Diethylhexyl Succinate

CAS Number	2915-57-3
PubChem CID	102903
IUPAC Name	bis(2-ethylhexyl) butanedioate
Molecular Formula	C20H38O4
Molecular Weight	342.5
XLogP	6.1
Topological Polar Surface Area	52.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	17
Heavy Atom Count	24
Formal Charge	0
Complexity	296

SMILES

CCCCC(CC)COC(=O)CCC(=O)OCC(CC)CCCC

InChI

InChI=1S/C20H38O4/c1-5-9-11-17(7-3)15-23-19(21)13-14-20(22)24-16-18(8-4)12-10-6-2/h17-18H,5-16H2,1-4H3

InChIKey

WMNULTDOANGXRT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2915-57-3

CID: 102903

Formula: C20H38O4

MW: 342.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	342.5
XLogP3	6.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	17
Exact Mass	342.27700969
Monoisotopic Mass	342.27700969
Topological Polar Surface Area	52.6 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	296
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
FE30030-01	Bis (2-Ethylhexyl) phosphate
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FB34371-01	Bis (2-Ethylhexyl) sebacate
RAA36897-01	Bis (2-ethylhexyl) phenyl phosphate
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MEA72495-01	N, N-Bis (2-ethylhexyl) -2-methylpropanamide
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