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6716-66-1 | Spiro[cyclohexane-1,1'-[1H]pyrido[3,4-b]indole], 2',3',4',9'-tetrahydro-
CAS No: 6716-66-1 Catalog No: AG006420 MDL No:
Product Description
Catalog Number:
AG006420
Chemical Name:
Spiro[cyclohexane-1,1'-[1H]pyrido[3,4-b]indole], 2',3',4',9'-tetrahydro-
CAS Number:
6716-66-1
Molecular Formula:
C16H20N2
Molecular Weight:
240.3434
IUPAC Name:
spiro[2,3,4,9-tetrahydropyrido[3,4-b]indole-1,1'-cyclohexane]
InChI:
InChI=1S/C16H20N2/c1-4-9-16(10-5-1)15-13(8-11-17-16)12-6-2-3-7-14(12)18-15/h2-3,6-7,17-18H,1,4-5,8-11H2
InChI Key:
OTFRJPUPCOSKKS-UHFFFAOYSA-N
SMILES:
C1CCC2(CC1)NCCc1c2[nH]c2c1cccc2
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.163g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
240.35g/mol
Monoisotopic Mass:
240.163g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
27.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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