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Home > Pyridines > 1211534-87-0
1211534-87-0 | 6,7,8,9-tetrahydro-5H-pyrido[3,2-d]azepine
CAS No: 1211534-87-0 Catalog No: AG00HFYJ MDL No:MFCD18258965
Product Description
Catalog Number:
AG00HFYJ
Chemical Name:
6,7,8,9-tetrahydro-5H-pyrido[3,2-d]azepine
CAS Number:
1211534-87-0
Molecular Formula:
C9H12N2
Molecular Weight:
148.2050
MDL Number:
MFCD18258965
IUPAC Name:
6,7,8,9-tetrahydro-5H-pyrido[2,3-d]azepine
InChI:
InChI=1S/C9H12N2/c1-2-8-3-6-10-7-4-9(8)11-5-1/h1-2,5,10H,3-4,6-7H2
InChI Key:
QIBPEANLJGMFBP-UHFFFAOYSA-N
SMILES:
N1CCc2c(CC1)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:
0.8
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