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Home > Pyridines > 802852-35-3
802852-35-3 | 1H-Azepine,hexahydro-5-methyl-2-(2-pyridylmethylene)-(8CI)
CAS No: 802852-35-3 Catalog No: AG00GQZO MDL No:
Product Description
Catalog Number:
AG00GQZO
Chemical Name:
1H-Azepine,hexahydro-5-methyl-2-(2-pyridylmethylene)-(8CI)
CAS Number:
802852-35-3
IUPAC Name:
(2E)-5-methyl-2-(pyridin-2-ylmethylidene)azepane
InChI:
InChI=1S/C13H18N2/c1-11-5-6-13(15-9-7-11)10-12-4-2-3-8-14-12/h2-4,8,10-11,15H,5-7,9H2,1H3/b13-10+
InChI Key:
RLGFQVQMTLGJSY-JLHYYAGUSA-N
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
202.147g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.301g/mol
Monoisotopic Mass:
202.147g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
24.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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