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1000343-13-4

1000343-13-4 | 1H-Indole, 5-bromo-6-methyl-

CAS No: 1000343-13-4 Catalog No: AG0000KY MDL No:MFCD09026969

Product Description

Catalog Number:
AG0000KY
Chemical Name:
1H-Indole, 5-bromo-6-methyl-
CAS Number:
1000343-13-4
Molecular Formula:
C9H8BrN
Molecular Weight:
210.0705
MDL Number:
MFCD09026969
IUPAC Name:
5-bromo-6-methyl-1H-indole
InChI:
InChI=1S/C9H8BrN/c1-6-4-9-7(2-3-11-9)5-8(6)10/h2-5,11H,1H3
InChI Key:
VHHRJOFNSFDEHH-UHFFFAOYSA-N
SMILES:
Brc1cc2cc[nH]c2cc1C

Properties

Complexity:
149  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.984g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
210.074g/mol
Monoisotopic Mass:
208.984g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

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