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Home > Indoles and Oxindole > 134331-71-8
134331-71-8 | 1,2,3,4-TETRAHYDRO-9-(PHENYLMETHYL)-PYRIDO[3,4-B]INDOLE
CAS No: 134331-71-8 Catalog No: AG0070S5 MDL No:MFCD04972103
Product Description
Catalog Number:
AG0070S5
Chemical Name:
1,2,3,4-TETRAHYDRO-9-(PHENYLMETHYL)-PYRIDO[3,4-B]INDOLE
CAS Number:
134331-71-8
Molecular Formula:
C18H18N2
Molecular Weight:
262.3489
MDL Number:
MFCD04972103
IUPAC Name:
9-benzyl-1,2,3,4-tetrahydropyrido[3,4-b]indole
InChI:
InChI=1S/C18H18N2/c1-2-6-14(7-3-1)13-20-17-9-5-4-8-15(17)16-10-11-19-12-18(16)20/h1-9,19H,10-13H2
InChI Key:
SROMRGBJXFAAJU-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)Cn1c2CNCCc2c2c1cccc2
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.147g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
262.356g/mol
Monoisotopic Mass:
262.147g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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