Home Other Building Blocks 2-Butenedioic acid (2E)-, 1,4-bis(2-ethylhexyl) ester

2-Butenedioic acid (2E)-, 1,4-bis(2-ethylhexyl) ester

CAS No.:
141-02-6
Catalog Number:
AG001FPE
Molecular Formula:
C20H36O4
Molecular Weight:
340.4974
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
1 week
United States
$99
- +
5g
1 week
United States
$153
- +
10g
1 week
United States
$191
- +
Product Description
Catalog Number:
AG001FPE
Chemical Name:
2-Butenedioic acid (2E)-, 1,4-bis(2-ethylhexyl) ester
CAS Number:
141-02-6
Molecular Formula:
C20H36O4
Molecular Weight:
340.4974
MDL Number:
MFCD00065144
IUPAC Name:
bis(2-ethylhexyl) (E)-but-2-enedioate
InChI:
InChI=1S/C20H36O4/c1-5-9-11-17(7-3)15-23-19(21)13-14-20(22)24-16-18(8-4)12-10-6-2/h13-14,17-18H,5-12,15-16H2,1-4H3/b14-13+
InChI Key:
ROPXFXOUUANXRR-BUHFOSPRSA-N
SMILES:
CCCCC(COC(=O)/C=C/C(=O)OCC(CCCC)CC)CC
EC Number:
205-448-2
Properties
Complexity:
329  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
340.261g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
340.504g/mol
Monoisotopic Mass:
340.261g/mol
Rotatable Bond Count:
16  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
6.5  
Properties