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2094713-86-5

2094713-86-5 | 4-(pyridin-4-yl)azepane dihydrochloride

CAS No: 2094713-86-5 Catalog No: AG01E7SH MDL No:MFCD30734290

Product Description

Catalog Number:
AG01E7SH
Chemical Name:
4-(pyridin-4-yl)azepane dihydrochloride
CAS Number:
2094713-86-5
MDL Number:
MFCD30734290
IUPAC Name:
4-pyridin-4-ylazepane;dihydrochloride
InChI:
InChI=1S/C11H16N2.2ClH/c1-2-10(3-7-12-6-1)11-4-8-13-9-5-11;;/h4-5,8-10,12H,1-3,6-7H2;2*1H
InChI Key:
NZCYNRUINAEGGS-UHFFFAOYSA-N

Properties

Complexity:
141  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.085g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
249.179g/mol
Monoisotopic Mass:
248.085g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
24.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0

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