Home Carboxys tert-Butyl 3-oxocyclobutanecarboxylate

tert-Butyl 3-oxocyclobutanecarboxylate

CAS No.:
145549-76-4
Catalog Number:
AG001D61
Molecular Formula:
C9H14O3
Molecular Weight:
170.2057
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$22
- +
5g
95%
In Stock USA
United States
$49
- +
10g
95%
In Stock USA
United States
$69
- +
25g
95%
In Stock USA
United States
$134
- +
Product Description
Catalog Number:
AG001D61
Chemical Name:
tert-Butyl 3-oxocyclobutanecarboxylate
CAS Number:
145549-76-4
Molecular Formula:
C9H14O3
Molecular Weight:
170.2057
MDL Number:
MFCD12827541
IUPAC Name:
tert-butyl 3-oxocyclobutane-1-carboxylate
InChI:
InChI=1S/C9H14O3/c1-9(2,3)12-8(11)6-4-7(10)5-6/h6H,4-5H2,1-3H3
InChI Key:
JINYZTGTQXDUQR-UHFFFAOYSA-N
SMILES:
O=C(C1CC(=O)C1)OC(C)(C)C
Properties
Complexity:
204  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.094g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.208g/mol
Monoisotopic Mass:
170.094g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties