Name: Name:5-ethyl-hexahydro-1H-cyclopenta[c]furan-1,3-dione, Mixture of diastereomers
Brand: Angene
SKU: AG01AFQ5
Rating: 90 (10 reviews)

5-ethyl-hexahydro-1H-cyclopenta[c]furan-1,3-dione, Mixture of diastereomers

CAS No.:

1935324-77-8

Catalog Number:

AG01AFQ5

Molecular Formula:

C9H12O3

Molecular Weight:

168.1898

Catalog Number:

AG01AFQ5

Chemical Name:

5-ethyl-hexahydro-1H-cyclopenta[c]furan-1,3-dione, Mixture of diastereomers

CAS Number:

1935324-77-8

Molecular Formula:

C9H12O3

Molecular Weight:

168.1898

MDL Number:

MFCD31617487

IUPAC Name:

5-ethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[c]furan-1,3-dione

InChI:

InChI=1S/C9H12O3/c1-2-5-3-6-7(4-5)9(11)12-8(6)10/h5-7H,2-4H2,1H3

InChI Key:

KFBVRXMOWPMGTH-UHFFFAOYSA-N

SMILES:

CCC1CC2C(C1)C(=O)OC2=O

Complexity:

212

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

168.079g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

168.192g/mol

Monoisotopic Mass:

168.079g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

43.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4