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Home > Bromides > 1420537-60-5
1420537-60-5 | 1H-Indole-2-carbonitrile, 6-bromo-
CAS No: 1420537-60-5 Catalog No: AG001HN0 MDL No:MFCD22689155
Product Description
Catalog Number:
AG001HN0
Chemical Name:
1H-Indole-2-carbonitrile, 6-bromo-
CAS Number:
1420537-60-5
Molecular Formula:
C9H5BrN2
Molecular Weight:
221.0534
MDL Number:
MFCD22689155
IUPAC Name:
6-bromo-1H-indole-2-carbonitrile
InChI:
InChI=1S/C9H5BrN2/c10-7-2-1-6-3-8(5-11)12-9(6)4-7/h1-4,12H
InChI Key:
MMTZWOPSFGBVSK-UHFFFAOYSA-N
SMILES:
N#Cc1cc2c([nH]1)cc(cc2)Br
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.964g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
221.057g/mol
Monoisotopic Mass:
219.964g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
39.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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