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Home Aldehydes 1-(3-Chlorobenzyl)-1h-indole-3-carbaldehyde

1-(3-Chlorobenzyl)-1h-indole-3-carbaldehyde

CAS No.:
90815-01-3
Catalog Number:
AG00H270
Molecular Formula:
C16H12ClNO
Molecular Weight:
269.7256
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$226
- +
5g
95%
In Stock USA
United States
$671
- +
Product Description
Catalog Number:
AG00H270
Chemical Name:
1-(3-Chlorobenzyl)-1h-indole-3-carbaldehyde
CAS Number:
90815-01-3
Molecular Formula:
C16H12ClNO
Molecular Weight:
269.7256
MDL Number:
MFCD03422505
IUPAC Name:
1-[(3-chlorophenyl)methyl]indole-3-carbaldehyde
InChI:
InChI=1S/C16H12ClNO/c17-14-5-3-4-12(8-14)9-18-10-13(11-19)15-6-1-2-7-16(15)18/h1-8,10-11H,9H2
InChI Key:
NANCGWIQWABHDC-UHFFFAOYSA-N
SMILES:
O=Cc1cn(c2c1cccc2)Cc1cccc(c1)Cl
NSC Number:
741908
Properties
Complexity:
322  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.061g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.728g/mol
Monoisotopic Mass:
269.061g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Literature
Title Journal
Analogues and derivatives of oncrasin-1, a novel inhibitor of the C-terminal domain of RNA polymerase II and their antitumor activities. Journal of medicinal chemistry 20110428
Properties