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857352-49-9 | 1,3-Dioxolane, 2-methoxy-2,4,4,5,5-pentamethyl-
CAS No: 857352-49-9 Catalog No: AG004S79 MDL No:
Product Description
Catalog Number:
AG004S79
Chemical Name:
1,3-Dioxolane, 2-methoxy-2,4,4,5,5-pentamethyl-
CAS Number:
857352-49-9
Molecular Formula:
C9H18O3
Molecular Weight:
174.2374
IUPAC Name:
2-methoxy-2,4,4,5,5-pentamethyl-1,3-dioxolane
InChI:
InChI=1S/C9H18O3/c1-7(2)8(3,4)12-9(5,10-6)11-7/h1-6H3
InChI Key:
IBINLOXCQMWAOA-UHFFFAOYSA-N
SMILES:
COC1(C)OC(C(O1)(C)C)(C)C
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.126g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.24g/mol
Monoisotopic Mass:
174.126g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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