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26450-58-8

26450-58-8 | Pentane, 1,1-dimethoxy-

CAS No: 26450-58-8 Catalog No: AG002TAD MDL No:

Product Description

Catalog Number:
AG002TAD
Chemical Name:
Pentane, 1,1-dimethoxy-
CAS Number:
26450-58-8
Molecular Formula:
C7H16O2
Molecular Weight:
132.2007
IUPAC Name:
1,1-dimethoxypentane
InChI:
InChI=1S/C7H16O2/c1-4-5-6-7(8-2)9-3/h7H,4-6H2,1-3H3
InChI Key:
VMOZJXZMOQSSMH-UHFFFAOYSA-N
SMILES:
CCCCC(OC)OC
EC Number:
247-716-1

Properties

Complexity:
50.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.115g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
132.203g/mol
Monoisotopic Mass:
132.115g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  

Literature

Title Journal
Scope and facial selectivity of the Prins-pinacol synthesis of attached rings. The Journal of organic chemistry 20060217

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