Home Halogens 4,6-dichloro-1H-indole-3-carbaldehyde

4,6-dichloro-1H-indole-3-carbaldehyde

CAS No.:
115666-33-6
Catalog Number:
AG01BD8B
Molecular Formula:
C9H5Cl2NO
Molecular Weight:
214.0481
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Product Description
Catalog Number:
AG01BD8B
Chemical Name:
4,6-dichloro-1H-indole-3-carbaldehyde
CAS Number:
115666-33-6
Molecular Formula:
C9H5Cl2NO
Molecular Weight:
214.0481
MDL Number:
MFCD15201261
IUPAC Name:
4,6-dichloro-1H-indole-3-carbaldehyde
InChI:
InChI=1S/C9H5Cl2NO/c10-6-1-7(11)9-5(4-13)3-12-8(9)2-6/h1-4,12H
InChI Key:
HAZSSFNTBOHWSZ-UHFFFAOYSA-N
SMILES:
O=Cc1c[nH]c2c1c(Cl)cc(c2)Cl
Properties
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.975g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
214.045g/mol
Monoisotopic Mass:
212.975g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
32.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties