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Home Other Building Blocks 1,3-Dioxolane,2-ethyl-4-methyl-

1,3-Dioxolane,2-ethyl-4-methyl-

CAS No.:
4359-46-0
Catalog Number:
AG0073J0
Molecular Formula:
C6H12O2
Molecular Weight:
116.1583
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Product Description
Catalog Number:
AG0073J0
Chemical Name:
1,3-Dioxolane,2-ethyl-4-methyl-
CAS Number:
4359-46-0
Molecular Formula:
C6H12O2
Molecular Weight:
116.1583
MDL Number:
MFCD16622267
IUPAC Name:
2-ethyl-4-methyl-1,3-dioxolane
InChI:
InChI=1S/C6H12O2/c1-3-6-7-4-5(2)8-6/h5-6H,3-4H2,1-2H3
InChI Key:
CSZCLQLJVFLXLI-UHFFFAOYSA-N
SMILES:
CCC1OCC(O1)C
EC Number:
224-435-2
Properties
Complexity:
72.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
116.084g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
116.16g/mol
Monoisotopic Mass:
116.084g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Literature
Title Journal
Theoretical insight into oxidative decomposition of propylene carbonate in the lithium ion battery. The journal of physical chemistry. B 20090416
An acute taste and odour episode solved by olfactory GC-MS. Water science and technology : a journal of the International Association on Water Pollution Research 20070101
Properties