Home Halogens Ethyl 4,6-dichloro-1h-indole-2-carboxylate

Ethyl 4,6-dichloro-1h-indole-2-carboxylate

CAS No.:
53995-82-7
Catalog Number:
AG00I9MX
Molecular Formula:
C11H9Cl2NO2
Molecular Weight:
258.1007
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$94
- +
5g
95%
In Stock USA
United States
$375
- +
Product Description
Catalog Number:
AG00I9MX
Chemical Name:
Ethyl 4,6-dichloro-1h-indole-2-carboxylate
CAS Number:
53995-82-7
Molecular Formula:
C11H9Cl2NO2
Molecular Weight:
258.1007
MDL Number:
MFCD00800654
IUPAC Name:
ethyl 4,6-dichloro-1H-indole-2-carboxylate
InChI:
InChI=1S/C11H9Cl2NO2/c1-2-16-11(15)10-5-7-8(13)3-6(12)4-9(7)14-10/h3-5,14H,2H2,1H3
InChI Key:
YLAHLUPONQVSOT-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc2c([nH]1)cc(cc2Cl)Cl
Properties
Complexity:
275  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.001g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
258.098g/mol
Monoisotopic Mass:
257.001g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
42.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties