Name: Name:4,5,6,7-Tetrahydro-4,7-ethanoisobenzofuran-1,3-dione
Brand: Angene
SKU: AG003O6Q
Rating: 90 (10 reviews)

4,5,6,7-Tetrahydro-4,7-ethanoisobenzofuran-1,3-dione

CAS No.:

151813-29-5

Catalog Number:

AG003O6Q

Molecular Formula:

C10H10O3

Molecular Weight:

178.1846

Catalog Number:

AG003O6Q

Chemical Name:

4,5,6,7-Tetrahydro-4,7-ethanoisobenzofuran-1,3-dione

CAS Number:

151813-29-5

Molecular Formula:

C10H10O3

Molecular Weight:

178.1846

MDL Number:

MFCD01318101

IUPAC Name:

4-oxatricyclo[5.2.2.02,6]undec-2(6)-ene-3,5-dione

InChI:

InChI=1S/C10H10O3/c11-9-7-5-1-2-6(4-3-5)8(7)10(12)13-9/h5-6H,1-4H2

InChI Key:

ZECOOENHOVXEDD-UHFFFAOYSA-N

SMILES:

O=C1OC(=O)C2=C1C1CCC2CC1

Complexity:

300

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

178.063g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

178.187g/mol

Monoisotopic Mass:

178.063g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

43.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7