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67203-48-9 | 6,7,8,9-tetrahydro-5H-pyrido[3,2-b]azepine
CAS No: 67203-48-9 Catalog No: AG00FG8W MDL No:MFCD18384647
Product Description
Catalog Number:
AG00FG8W
Chemical Name:
6,7,8,9-tetrahydro-5H-pyrido[3,2-b]azepine
CAS Number:
67203-48-9
Molecular Formula:
C9H12N2
Molecular Weight:
148.2050
MDL Number:
MFCD18384647
IUPAC Name:
6,7,8,9-tetrahydro-5H-pyrido[3,2-b]azepine
InChI:
InChI=1S/C9H12N2/c1-2-6-10-9-5-3-7-11-8(9)4-1/h3,5,7,10H,1-2,4,6H2
InChI Key:
ILVDDECKGYUWPI-UHFFFAOYSA-N
SMILES:
C1CCc2c(NC1)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:
1.6
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