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Home > Pyridines > 1803585-34-3
1803585-34-3 | 5H,6H,7H,8H,9H-pyrido[3,2-c]azepine
CAS No: 1803585-34-3 Catalog No: AG01BCU5 MDL No:MFCD27938666
Product Description
Catalog Number:
AG01BCU5
Chemical Name:
5H,6H,7H,8H,9H-pyrido[3,2-c]azepine
CAS Number:
1803585-34-3
Molecular Formula:
C9H12N2
Molecular Weight:
148.2050
MDL Number:
MFCD27938666
IUPAC Name:
6,7,8,9-tetrahydro-5H-pyrido[3,2-c]azepine
InChI:
InChI=1S/C9H12N2/c1-3-8-7-10-5-2-4-9(8)11-6-1/h1,3,6,10H,2,4-5,7H2
InChI Key:
VVDHIRGUDDNSAN-UHFFFAOYSA-N
SMILES:
C1CCc2c(CN1)cccn2
Properties
Complexity:
125
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.1g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
148.209g/mol
Monoisotopic Mass:
148.1g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
24.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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