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139996-08-0 | Pentane, 2-(dimethoxymethyl)-1,1,5,5-tetramethoxy-
CAS No: 139996-08-0 Catalog No: AG001BWO MDL No:
Product Description
Catalog Number:
AG001BWO
Chemical Name:
Pentane, 2-(dimethoxymethyl)-1,1,5,5-tetramethoxy-
CAS Number:
139996-08-0
Molecular Formula:
C12H26O6
Molecular Weight:
266.3312
IUPAC Name:
2-(dimethoxymethyl)-1,1,5,5-tetramethoxypentane
InChI:
InChI=1S/C12H26O6/c1-13-10(14-2)8-7-9(11(15-3)16-4)12(17-5)18-6/h9-12H,7-8H2,1-6H3
InChI Key:
XZYFYWSDHYYJPJ-UHFFFAOYSA-N
SMILES:
COC(CCC(C(OC)OC)C(OC)OC)OC
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.173g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.334g/mol
Monoisotopic Mass:
266.173g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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