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655-47-0

655-47-0 | 2,3-Bis-(4-pyridyl)butane

CAS No: 655-47-0 Catalog No: AG01EWT2 MDL No:MFCD06637444

Product Description

Catalog Number:
AG01EWT2
Chemical Name:
2,3-Bis-(4-pyridyl)butane
CAS Number:
655-47-0
Molecular Formula:
C14H16N2
Molecular Weight:
212.2902
MDL Number:
MFCD06637444
IUPAC Name:
4-(3-pyridin-4-ylbutan-2-yl)pyridine
InChI:
InChI=1S/C14H16N2/c1-11(13-3-7-15-8-4-13)12(2)14-5-9-16-10-6-14/h3-12H,1-2H3
InChI Key:
XGJXWHRUXUVTKK-UHFFFAOYSA-N
SMILES:
CC(C(c1ccncc1)C)c1ccncc1

Properties

Complexity:
171  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.131g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.296g/mol
Monoisotopic Mass:
212.131g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

Literature

Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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