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23046-74-4 | 1H-Pyrido[3,4-b]indole, 2,3,4,9-tetrahydro-8-methyl-
CAS No: 23046-74-4 Catalog No: AG002M0A MDL No:MFCD20665445
Product Description
Catalog Number:
AG002M0A
Chemical Name:
1H-Pyrido[3,4-b]indole, 2,3,4,9-tetrahydro-8-methyl-
CAS Number:
23046-74-4
Molecular Formula:
C12H14N2
Molecular Weight:
186.2530
MDL Number:
MFCD20665445
IUPAC Name:
8-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
InChI:
InChI=1S/C12H14N2/c1-8-3-2-4-10-9-5-6-13-7-11(9)14-12(8)10/h2-4,13-14H,5-7H2,1H3
InChI Key:
BTKJQUALQIBJKQ-UHFFFAOYSA-N
SMILES:
Cc1cccc2c1[nH]c1c2CCNC1
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.116g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
186.258g/mol
Monoisotopic Mass:
186.116g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
27.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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