Name: Name:2-oxo-2-{4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptan-2-yl}acetic acid
Brand: Angene
SKU: AG019MP6
Rating: 90 (10 reviews)

2-oxo-2-{4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptan-2-yl}acetic acid

CAS No.:

10277-34-6

Catalog Number:

AG019MP6

Molecular Formula:

C12H16O4

Molecular Weight:

224.2530

Catalog Number:

AG019MP6

Chemical Name:

2-oxo-2-{4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptan-2-yl}acetic acid

CAS Number:

10277-34-6

Molecular Formula:

C12H16O4

Molecular Weight:

224.2530

MDL Number:

MFCD11836298

IUPAC Name:

2-oxo-2-(4,7,7-trimethyl-3-oxo-2-bicyclo[2.2.1]heptanyl)acetic acid

InChI:

InChI=1S/C12H16O4/c1-11(2)6-4-5-12(11,3)9(14)7(6)8(13)10(15)16/h6-7H,4-5H2,1-3H3,(H,15,16)

InChI Key:

JZNKIJDJYKNHEP-UHFFFAOYSA-N

SMILES:

OC(=O)C(=O)C1C(=O)C2(C(C1CC2)(C)C)C

Complexity:

396

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

224.105g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

224.256g/mol

Monoisotopic Mass:

224.105g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

71.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9