Name: Name:ethyl 2-oxo-3,4,5,6,7,8-hexahydronaphthalene-4a-carboxylate
Brand: Angene
SKU: AG005TOV
Rating: 90 (10 reviews)

ethyl 2-oxo-3,4,5,6,7,8-hexahydronaphthalene-4a-carboxylate

CAS No.:

7478-39-9

Catalog Number:

AG005TOV

Molecular Formula:

C13H18O3

Molecular Weight:

222.2802

Catalog Number:

AG005TOV

Chemical Name:

ethyl 2-oxo-3,4,5,6,7,8-hexahydronaphthalene-4a-carboxylate

CAS Number:

7478-39-9

Molecular Formula:

C13H18O3

Molecular Weight:

222.2802

MDL Number:

MFCD19302675

IUPAC Name:

ethyl 7-oxo-1,2,3,4,5,6-hexahydronaphthalene-4a-carboxylate

InChI:

InChI=1S/C13H18O3/c1-2-16-12(15)13-7-4-3-5-10(13)9-11(14)6-8-13/h9H,2-8H2,1H3

InChI Key:

SRDFWBNFGXTHOY-UHFFFAOYSA-N

SMILES:

CCOC(=O)C12CCCCC2=CC(=O)CC1

NSC Number:

402916

Complexity:

343

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

222.126g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

222.284g/mol

Monoisotopic Mass:

222.126g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

43.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7