Name: Name:Butanoic acid, 3-oxo-, 1,1'-(1,3-propanediyl) ester
Brand: Angene
SKU: AG001ZP3
Rating: 90 (10 reviews)

Butanoic acid, 3-oxo-, 1,1'-(1,3-propanediyl) ester

CAS No.:

174498-06-7

Catalog Number:

AG001ZP3

Molecular Formula:

C11H16O6

Molecular Weight:

244.2411

Catalog Number:

AG001ZP3

Chemical Name:

Butanoic acid, 3-oxo-, 1,1'-(1,3-propanediyl) ester

CAS Number:

174498-06-7

Molecular Formula:

C11H16O6

Molecular Weight:

244.2411

MDL Number:

MFCD30478686

IUPAC Name:

3-(3-oxobutanoyloxy)propyl 3-oxobutanoate

InChI:

InChI=1S/C11H16O6/c1-8(12)6-10(14)16-4-3-5-17-11(15)7-9(2)13/h3-7H2,1-2H3

InChI Key:

LIDCCJYZVQPSGS-UHFFFAOYSA-N

SMILES:

O=C(CC(=O)C)OCCCOC(=O)CC(=O)C

Complexity:

277

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

244.095g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

244.243g/mol

Monoisotopic Mass:

244.095g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

86.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.1