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13002-11-4 | Propane, 1,1-bis(2-methylpropoxy)-
CAS No: 13002-11-4 Catalog No: AG000TXF MDL No:
Product Description
Catalog Number:
AG000TXF
Chemical Name:
Propane, 1,1-bis(2-methylpropoxy)-
CAS Number:
13002-11-4
Molecular Formula:
C11H24O2
Molecular Weight:
188.3071
IUPAC Name:
2-methyl-1-[1-(2-methylpropoxy)propoxy]propane
InChI:
InChI=1S/C11H24O2/c1-6-11(12-7-9(2)3)13-8-10(4)5/h9-11H,6-8H2,1-5H3
InChI Key:
USYFLBOYMYXIBN-UHFFFAOYSA-N
SMILES:
CCC(OCC(C)C)OCC(C)C
Properties
Complexity:
98.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.178g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.311g/mol
Monoisotopic Mass:
188.178g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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