Home Other Building Blocks 3-methyl-3-(2-methylpropyl)oxolane-2,5-dione

3-methyl-3-(2-methylpropyl)oxolane-2,5-dione

CAS No.:
1094403-53-8
Catalog Number:
AG019T8J
Molecular Formula:
C9H14O3
Molecular Weight:
170.2057
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Product Description
Catalog Number:
AG019T8J
Chemical Name:
3-methyl-3-(2-methylpropyl)oxolane-2,5-dione
CAS Number:
1094403-53-8
Molecular Formula:
C9H14O3
Molecular Weight:
170.2057
MDL Number:
MFCD11134325
IUPAC Name:
3-methyl-3-(2-methylpropyl)oxolane-2,5-dione
InChI:
InChI=1S/C9H14O3/c1-6(2)4-9(3)5-7(10)12-8(9)11/h6H,4-5H2,1-3H3
InChI Key:
STCQBUQMHAHLHG-UHFFFAOYSA-N
SMILES:
CC(CC1(C)CC(=O)OC1=O)C
Properties
Complexity:
220  
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:
2  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties