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129228-16-6 | Cyclohexane, [1,1-bis(methoxymethyl)-2-methylpropyl]-
CAS No: 129228-16-6 Catalog No: AG000YZP MDL No:
Product Description
Catalog Number:
AG000YZP
Chemical Name:
Cyclohexane, [1,1-bis(methoxymethyl)-2-methylpropyl]-
CAS Number:
129228-16-6
Molecular Formula:
C14H28O2
Molecular Weight:
228.3709
IUPAC Name:
[1-methoxy-2-(methoxymethyl)-3-methylbutan-2-yl]cyclohexane
InChI:
InChI=1S/C14H28O2/c1-12(2)14(10-15-3,11-16-4)13-8-6-5-7-9-13/h12-13H,5-11H2,1-4H3
InChI Key:
PQIDFVXMOZQINS-UHFFFAOYSA-N
SMILES:
COCC(C1CCCCC1)(C(C)C)COC
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.209g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.376g/mol
Monoisotopic Mass:
228.209g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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