Home Carboxys Methyl 4-formylbicyclo[2.2.2]octane-1-carboxylate

Methyl 4-formylbicyclo[2.2.2]octane-1-carboxylate

CAS No.:
94994-25-9
Catalog Number:
AG00IIOC
Molecular Formula:
C11H16O3
Molecular Weight:
196.2429
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$225
- +
250mg
95%
In Stock USA
United States
$391
- +
Product Description
Catalog Number:
AG00IIOC
Chemical Name:
Methyl 4-formylbicyclo[2.2.2]octane-1-carboxylate
CAS Number:
94994-25-9
Molecular Formula:
C11H16O3
Molecular Weight:
196.2429
MDL Number:
MFCD23102903
IUPAC Name:
methyl 4-formylbicyclo[2.2.2]octane-1-carboxylate
InChI:
InChI=1S/C11H16O3/c1-14-9(13)11-5-2-10(8-12,3-6-11)4-7-11/h8H,2-7H2,1H3
InChI Key:
KNSYWHCOJRHWRP-UHFFFAOYSA-N
SMILES:
COC(=O)C12CCC(CC1)(CC2)C=O
Properties
Complexity:
245  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.11g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.246g/mol
Monoisotopic Mass:
196.11g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties