Name: Name:3aH-Indene-3a-carboxylicacid, 1,2,3,4,5,6-hexahydro-6-oxo-, ethyl ester
Brand: Angene
SKU: AG006LS3
Rating: 90 (10 reviews)

3aH-Indene-3a-carboxylicacid, 1,2,3,4,5,6-hexahydro-6-oxo-, ethyl ester

CAS No.:

65969-71-3

Catalog Number:

AG006LS3

Molecular Formula:

C12H16O3

Molecular Weight:

208.2536

Catalog Number:

AG006LS3

Chemical Name:

3aH-Indene-3a-carboxylicacid, 1,2,3,4,5,6-hexahydro-6-oxo-, ethyl ester

CAS Number:

65969-71-3

Molecular Formula:

C12H16O3

Molecular Weight:

208.2536

MDL Number:

MFCD31665149

IUPAC Name:

ethyl 6-oxo-2,3,4,5-tetrahydro-1H-indene-3a-carboxylate

InChI:

InChI=1S/C12H16O3/c1-2-15-11(14)12-6-3-4-9(12)8-10(13)5-7-12/h8H,2-7H2,1H3

InChI Key:

BNROREXUPUDIJE-UHFFFAOYSA-N

SMILES:

CCOC(=O)C12CCCC2=CC(=O)CC1

NSC Number:

179346

Complexity:

330

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

208.11g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

208.257g/mol

Monoisotopic Mass:

208.11g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

43.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1