Home Aldehydes 4-Chloroindole-3-carbaldehyde

4-Chloroindole-3-carbaldehyde

CAS No.:
876-72-2
Catalog Number:
AG004O02
Molecular Formula:
C9H6ClNO
Molecular Weight:
179.6030
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$63
- +
5g
97%
In Stock USA
United States
$219
- +
10g
97%
In Stock USA
United States
$319
- +
Product Description
Catalog Number:
AG004O02
Chemical Name:
4-Chloroindole-3-carbaldehyde
CAS Number:
876-72-2
Molecular Formula:
C9H6ClNO
Molecular Weight:
179.6030
MDL Number:
MFCD05864704
IUPAC Name:
4-chloro-1H-indole-3-carbaldehyde
InChI:
InChI=1S/C9H6ClNO/c10-7-2-1-3-8-9(7)6(5-12)4-11-8/h1-5,11H
InChI Key:
MSYJFNQAVTYKOP-UHFFFAOYSA-N
SMILES:
O=Cc1c[nH]c2c1c(Cl)ccc2
Properties
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.014g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
179.603g/mol
Monoisotopic Mass:
179.014g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
32.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties