Home Nitros 6-Chloro-5-nitro-1h-indole

6-Chloro-5-nitro-1h-indole

CAS No.:
172078-39-6
Catalog Number:
AG00HZKC
Molecular Formula:
C8H5ClN2O2
Molecular Weight:
196.5905
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Product Description
Catalog Number:
AG00HZKC
Chemical Name:
6-Chloro-5-nitro-1h-indole
CAS Number:
172078-39-6
Molecular Formula:
C8H5ClN2O2
Molecular Weight:
196.5905
MDL Number:
MFCD28659862
IUPAC Name:
6-chloro-5-nitro-1H-indole
InChI:
InChI=1S/C8H5ClN2O2/c9-6-4-7-5(1-2-10-7)3-8(6)11(12)13/h1-4,10H
InChI Key:
WZVBKWHXWRBUHL-UHFFFAOYSA-N
SMILES:
O=N(=O)c1cc2cc[nH]c2cc1Cl
Properties
Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.004g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
196.59g/mol
Monoisotopic Mass:
196.004g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties