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Home > Indoles and Oxindole > 1803607-15-9
1803607-15-9 | 1H,2H,3H,4H,5H,6H-azepino[4,3-b]indole hydrochloride
CAS No: 1803607-15-9 Catalog No: AG01BFT4 MDL No:MFCD28125030
Product Description
Catalog Number:
AG01BFT4
Chemical Name:
1H,2H,3H,4H,5H,6H-azepino[4,3-b]indole hydrochloride
CAS Number:
1803607-15-9
Molecular Formula:
C12H15ClN2
Molecular Weight:
222.7139
MDL Number:
MFCD28125030
IUPAC Name:
1,2,3,4,5,6-hexahydroazepino[4,3-b]indole;hydrochloride
InChI:
InChI=1S/C12H14N2.ClH/c1-2-5-11-9(4-1)10-8-13-7-3-6-12(10)14-11;/h1-2,4-5,13-14H,3,6-8H2;1H
InChI Key:
AOGDPVDTQIUKDF-UHFFFAOYSA-N
SMILES:
C1CCc2c(CN1)c1c([nH]2)cccc1.Cl
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.092g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
222.716g/mol
Monoisotopic Mass:
222.092g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
27.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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