Name: Name:2,3,5,6-tetrachloro-4,4-dimethoxypentacyclo[5.4.0.0^{2,6}.0^{3,10}.0^{5,9}]undecane-8,11-dione
Brand: Angene
SKU: AG019WBF
Rating: 90 (10 reviews)

2,3,5,6-tetrachloro-4,4-dimethoxypentacyclo[5.4.0.0^{2,6}.0^{3,10}.0^{5,9}]undecane-8,11-dione

CAS No.:

50874-39-0

Catalog Number:

AG019WBF

Molecular Formula:

C13H10Cl4O4

Molecular Weight:

372.0281

Catalog Number:

AG019WBF

Chemical Name:

2,3,5,6-tetrachloro-4,4-dimethoxypentacyclo[5.4.0.0^{2,6}.0^{3,10}.0^{5,9}]undecane-8,11-dione

CAS Number:

50874-39-0

Molecular Formula:

C13H10Cl4O4

Molecular Weight:

372.0281

MDL Number:

MFCD00220291

IUPAC Name:

2,3,5,6-tetrachloro-4,4-dimethoxypentacyclo[5.4.0.02,6.03,10.05,9]undecane-8,11-dione

InChI:

InChI=1S/C13H10Cl4O4/c1-20-13(21-2)11(16)5-6-8(19)4-3(7(5)18)9(11,14)10(4,15)12(6,13)17/h3-6H,1-2H3

InChI Key:

IXQXXDRHGCNCJI-UHFFFAOYSA-N

SMILES:

COC1(OC)C2(Cl)C3C4C1(Cl)C1(C2(Cl)C(C3=O)C1C4=O)Cl

NSC Number:

143947

Complexity:

613

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

371.93g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

372.019g/mol

Monoisotopic Mass:

369.933g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

52.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.2