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Home Carboxys 4-Oxo-tetrahydro-furan-3-carboxylic acid tert-butyl ester

4-Oxo-tetrahydro-furan-3-carboxylic acid tert-butyl ester

CAS No.:
797038-32-5
Catalog Number:
AG00ID2H
Molecular Formula:
C9H14O4
Molecular Weight:
186.2051
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$133
- +
250mg
95%
In Stock USA
United States
$221
- +
1g
95%
In Stock USA
United States
$441
- +
Product Description
Catalog Number:
AG00ID2H
Chemical Name:
4-Oxo-tetrahydro-furan-3-carboxylic acid tert-butyl ester
CAS Number:
797038-32-5
Molecular Formula:
C9H14O4
Molecular Weight:
186.2051
MDL Number:
MFCD21362347
IUPAC Name:
tert-butyl 4-oxooxolane-3-carboxylate
InChI:
InChI=1S/C9H14O4/c1-9(2,3)13-8(11)6-4-12-5-7(6)10/h6H,4-5H2,1-3H3
InChI Key:
VAYGRVNWVNMUQL-UHFFFAOYSA-N
SMILES:
O=C(C1COC=C1O)OC(C)(C)C
Properties
Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.089g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.207g/mol
Monoisotopic Mass:
186.089g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties