Name: Name:Ethanedioic acid, 1,2-bis[(4-methylphenyl)methyl] ester
Brand: Angene
SKU: AG0023VB
Rating: 90 (10 reviews)

Ethanedioic acid, 1,2-bis[(4-methylphenyl)methyl] ester

CAS No.:

18241-31-1

Catalog Number:

AG0023VB

Molecular Formula:

C18H18O4

Molecular Weight:

298.3331

Catalog Number:

AG0023VB

Chemical Name:

Ethanedioic acid, 1,2-bis[(4-methylphenyl)methyl] ester

CAS Number:

18241-31-1

Molecular Formula:

C18H18O4

Molecular Weight:

298.3331

MDL Number:

MFCD00266809

IUPAC Name:

bis[(4-methylphenyl)methyl] oxalate

InChI:

InChI=1S/C18H18O4/c1-13-3-7-15(8-4-13)11-21-17(19)18(20)22-12-16-9-5-14(2)6-10-16/h3-10H,11-12H2,1-2H3

InChI Key:

FPFZBTUMXCSRLU-UHFFFAOYSA-N

SMILES:

O=C(C(=O)OCc1ccc(cc1)C)OCc1ccc(cc1)C

EC Number:

406-470-7

Complexity:

327

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

298.121g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

298.338g/mol

Monoisotopic Mass:

298.121g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

52.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.1