Name: Name:Bicyclo[2.2.2]octane-1-carboxylic acid, methyl ester
Brand: Angene
SKU: AG00ILAL
Rating: 90 (10 reviews)

Bicyclo[2.2.2]octane-1-carboxylic acid, methyl ester

CAS No.:

2064-04-2

Catalog Number:

AG00ILAL

Molecular Formula:

C10H16O2

Molecular Weight:

168.2328

Catalog Number:

AG00ILAL

Chemical Name:

Bicyclo[2.2.2]octane-1-carboxylic acid, methyl ester

CAS Number:

2064-04-2

Molecular Formula:

C10H16O2

Molecular Weight:

168.2328

MDL Number:

MFCD29042868

IUPAC Name:

methyl bicyclo[2.2.2]octane-1-carboxylate

InChI:

InChI=1S/C10H16O2/c1-12-9(11)10-5-2-8(3-6-10)4-7-10/h8H,2-7H2,1H3

InChI Key:

ZZQHNCFQLQSTAS-UHFFFAOYSA-N

SMILES:

COC(=O)C12CCC(CC1)CC2

Complexity:

176

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

168.115g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

168.236g/mol

Monoisotopic Mass:

168.115g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

26.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4