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117809-57-1

117809-57-1 | Pyrazine, 2-chloro-5-[4-(decyloxy)phenyl]-

CAS No: 117809-57-1 Catalog No: AG000HV2 MDL No:

Product Description

Catalog Number:
AG000HV2
Chemical Name:
Pyrazine, 2-chloro-5-[4-(decyloxy)phenyl]-
CAS Number:
117809-57-1
Molecular Formula:
C20H27ClN2O
Molecular Weight:
346.8942
IUPAC Name:
2-chloro-5-(4-decoxyphenyl)pyrazine
InChI:
InChI=1S/C20H27ClN2O/c1-2-3-4-5-6-7-8-9-14-24-18-12-10-17(11-13-18)19-15-23-20(21)16-22-19/h10-13,15-16H,2-9,14H2,1H3
InChI Key:
IODUEBNHEOKQJQ-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCOc1ccc(cc1)c1ncc(nc1)Cl

Properties

Complexity:
308  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
346.181g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
346.899g/mol
Monoisotopic Mass:
346.181g/mol
Rotatable Bond Count:
11  
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.9  

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