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85092-82-6 | 1H-Indole,3-bromo-5-chloro-
CAS No: 85092-82-6 Catalog No: AG004XNH MDL No:MFCD06410767
Product Description
Catalog Number:
AG004XNH
Chemical Name:
1H-Indole,3-bromo-5-chloro-
CAS Number:
85092-82-6
Molecular Formula:
C8H5BrClN
Molecular Weight:
230.4890
MDL Number:
MFCD06410767
IUPAC Name:
3-bromo-5-chloro-1H-indole
InChI:
InChI=1S/C8H5BrClN/c9-7-4-11-8-2-1-5(10)3-6(7)8/h1-4,11H
InChI Key:
DYTMTLPTFUWUSO-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)c(Br)c[nH]2
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.929g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
230.489g/mol
Monoisotopic Mass:
228.929g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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