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113590-42-4

113590-42-4 | Pyridine, 3-(2-butyl-1,3-dioxolan-2-yl)-

CAS No: 113590-42-4 Catalog No: AG00092P MDL No:

Product Description

Catalog Number:
AG00092P
Chemical Name:
Pyridine, 3-(2-butyl-1,3-dioxolan-2-yl)-
CAS Number:
113590-42-4
Molecular Formula:
C12H17NO2
Molecular Weight:
207.2689
IUPAC Name:
3-(2-butyl-1,3-dioxolan-2-yl)pyridine
InChI:
InChI=1S/C12H17NO2/c1-2-3-6-12(14-8-9-15-12)11-5-4-7-13-10-11/h4-5,7,10H,2-3,6,8-9H2,1H3
InChI Key:
QEQIAFWSFHBAHH-UHFFFAOYSA-N
SMILES:
CCCCC1(OCCO1)c1cccnc1

Properties

Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.126g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.273g/mol
Monoisotopic Mass:
207.126g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  

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