Name: Name:pentacyclo[5.4.0.0^{2,6}.0^{3,10}.0^{5,9}]undecane-8-carboxylic acid
Brand: Angene
SKU: AG01BFN9
Rating: 90 (10 reviews)

pentacyclo[5.4.0.0^{2,6}.0^{3,10}.0^{5,9}]undecane-8-carboxylic acid

CAS No.:

1803561-83-2

Catalog Number:

AG01BFN9

Molecular Formula:

C12H14O2

Molecular Weight:

190.2384

Catalog Number:

AG01BFN9

Chemical Name:

pentacyclo[5.4.0.0^{2,6}.0^{3,10}.0^{5,9}]undecane-8-carboxylic acid

CAS Number:

1803561-83-2

Molecular Formula:

C12H14O2

Molecular Weight:

190.2384

MDL Number:

MFCD20264555

IUPAC Name:

pentacyclo[5.4.0.02,6.03,10.05,9]undecane-8-carboxylic acid

InChI:

InChI=1S/C12H14O2/c13-12(14)11-8-4-2-5-7-3(4)1-6(8)9(7)10(5)11/h3-11H,1-2H2,(H,13,14)

InChI Key:

UXKUWKVUGVNIHW-UHFFFAOYSA-N

SMILES:

OC(=O)C1C2C3C4C1C1CC2C(C3)C41

Complexity:

363

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

190.099g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

190.242g/mol

Monoisotopic Mass:

190.099g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

37.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8