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14738-96-6 | 1,3-Dioxole, 4-methyl-
CAS No: 14738-96-6 Catalog No: AG001EV4 MDL No:
Product Description
Catalog Number:
AG001EV4
Chemical Name:
1,3-Dioxole, 4-methyl-
CAS Number:
14738-96-6
Molecular Formula:
C4H6O2
Molecular Weight:
86.0892
IUPAC Name:
4-methyl-1,3-dioxole
InChI:
InChI=1S/C4H6O2/c1-4-2-5-3-6-4/h2H,3H2,1H3
InChI Key:
OHGDYNKEHUBFCC-UHFFFAOYSA-N
SMILES:
CC1=COCO1
Properties
Complexity:
75.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
86.037g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
86.09g/mol
Monoisotopic Mass:
86.037g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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