Home Carboxys Benzyl 3-oxocyclobutanecarboxylate

Benzyl 3-oxocyclobutanecarboxylate

CAS No.:
198995-91-4
Catalog Number:
AG002BUG
Molecular Formula:
C12H12O3
Molecular Weight:
204.2219
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$75
- +
5g
97%
In Stock USA
United States
$225
- +
25g
97%
In Stock USA
United States
$975
- +
Product Description
Catalog Number:
AG002BUG
Chemical Name:
Benzyl 3-oxocyclobutanecarboxylate
CAS Number:
198995-91-4
Molecular Formula:
C12H12O3
Molecular Weight:
204.2219
MDL Number:
MFCD11848894
IUPAC Name:
benzyl 3-oxocyclobutane-1-carboxylate
InChI:
InChI=1S/C12H12O3/c13-11-6-10(7-11)12(14)15-8-9-4-2-1-3-5-9/h1-5,10H,6-8H2
InChI Key:
OPGPYIKNRCXNQY-UHFFFAOYSA-N
SMILES:
O=C(C1CC(=O)C1)OCc1ccccc1
Properties
Complexity:
246  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.079g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.225g/mol
Monoisotopic Mass:
204.079g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties