Name: Name:1,2-Benzenedicarboxylicacid, 1-butyl 2-(2-ethylhexyl) ester
Brand: Angene
SKU: AG008H3C
Rating: 90 (10 reviews)

1,2-Benzenedicarboxylicacid, 1-butyl 2-(2-ethylhexyl) ester

CAS No.:

85-69-8

Catalog Number:

AG008H3C

Molecular Formula:

C20H30O4

Molecular Weight:

334.4498

Catalog Number:

AG008H3C

Chemical Name:

1,2-Benzenedicarboxylicacid, 1-butyl 2-(2-ethylhexyl) ester

CAS Number:

85-69-8

Molecular Formula:

C20H30O4

Molecular Weight:

334.4498

MDL Number:

MFCD00152314

IUPAC Name:

1-O-butyl 2-O-(2-ethylhexyl) benzene-1,2-dicarboxylate

InChI:

InChI=1S/C20H30O4/c1-4-7-11-16(6-3)15-24-20(22)18-13-10-9-12-17(18)19(21)23-14-8-5-2/h9-10,12-13,16H,4-8,11,14-15H2,1-3H3

InChI Key:

AVOLBYOSCILFLL-UHFFFAOYSA-N

SMILES:

CCCCOC(=O)c1ccccc1C(=O)OCC(CCCC)CC

EC Number:

201-623-2

Complexity:

367

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

334.214g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

334.456g/mol

Monoisotopic Mass:

334.214g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

52.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

5.6