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26447-43-8

26447-43-8 | 1-Propanol, (2-methylpropoxy)- (9CI)

CAS No: 26447-43-8 Catalog No: AG002T8N MDL No:

Product Description

Catalog Number:
AG002T8N
Chemical Name:
1-Propanol, (2-methylpropoxy)- (9CI)
CAS Number:
26447-43-8
Molecular Formula:
C7H16O2
Molecular Weight:
132.2007
IUPAC Name:
1-(2-methylpropoxy)propan-1-ol
InChI:
InChI=1S/C7H16O2/c1-4-7(8)9-5-6(2)3/h6-8H,4-5H2,1-3H3
InChI Key:
RVKCEMGSOAGADA-UHFFFAOYSA-N
SMILES:
CCC(OCC(C)C)O

Properties

Complexity:
61.9  
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:
1  
Isotope Atom Count:
0
Molecular Weight:
132.203g/mol
Monoisotopic Mass:
132.115g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

Literature

Title Journal
Continuous whey fermentation using kefir yeast immobilized on delignified cellulosic material. Journal of agricultural and food chemistry 20020424

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