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Home > Pyridines > 868065-45-6
868065-45-6 | 1H-1,4-Diazepine, hexahydro-1-(5-methyl-2-pyridinyl)-
CAS No: 868065-45-6 Catalog No: AG00IE7K MDL No:
Product Description
Catalog Number:
AG00IE7K
Chemical Name:
1H-1,4-Diazepine, hexahydro-1-(5-methyl-2-pyridinyl)-
CAS Number:
868065-45-6
IUPAC Name:
1-(5-methylpyridin-2-yl)-1,4-diazepane
InChI:
InChI=1S/C11H17N3/c1-10-3-4-11(13-9-10)14-7-2-5-12-6-8-14/h3-4,9,12H,2,5-8H2,1H3
InChI Key:
SMKRVCKHWYQEGX-UHFFFAOYSA-N
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.142g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.278g/mol
Monoisotopic Mass:
191.142g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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