Home Other Building Blocks 4,5,5-trimethyl-2,5-dihydrofuran-2-one

4,5,5-trimethyl-2,5-dihydrofuran-2-one

CAS No.:
4182-41-6
Catalog Number:
AG01C4YQ
Molecular Formula:
C7H10O2
Molecular Weight:
126.1531
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Product Description
Catalog Number:
AG01C4YQ
Chemical Name:
4,5,5-trimethyl-2,5-dihydrofuran-2-one
CAS Number:
4182-41-6
Molecular Formula:
C7H10O2
Molecular Weight:
126.1531
MDL Number:
MFCD29763240
IUPAC Name:
4,5,5-trimethylfuran-2-one
InChI:
InChI=1S/C7H10O2/c1-5-4-6(8)9-7(5,2)3/h4H,1-3H3
InChI Key:
ULWRKJUYKWNTOW-UHFFFAOYSA-N
SMILES:
O=C1C=C(C(O1)(C)C)C
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.068g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
126.155g/mol
Monoisotopic Mass:
126.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties