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144434-74-2

144434-74-2 | 9H-Pyrido[3,4-b]indole, 3,6-dibromo-1-methyl-

CAS No: 144434-74-2 Catalog No: AG001JJB MDL No:

Product Description

Catalog Number:
AG001JJB
Chemical Name:
9H-Pyrido[3,4-b]indole, 3,6-dibromo-1-methyl-
CAS Number:
144434-74-2
Molecular Formula:
C12H8Br2N2
Molecular Weight:
340.0133
IUPAC Name:
3,6-dibromo-1-methyl-9H-pyrido[3,4-b]indole
InChI:
InChI=1S/C12H8Br2N2/c1-6-12-9(5-11(14)15-6)8-4-7(13)2-3-10(8)16-12/h2-5,16H,1H3
InChI Key:
OTJUQRPMEHCTRS-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)c1cc(Br)nc(c1[nH]2)C

Properties

Complexity:
274  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.903g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
340.018g/mol
Monoisotopic Mass:
337.905g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4  

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