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Home Carboxys tert-Butyl 3-cyano-1H-indole-1-carboxylate

tert-Butyl 3-cyano-1H-indole-1-carboxylate

CAS No.:
908244-43-9
Catalog Number:
AG00IGAW
Molecular Formula:
C14H14N2O2
Molecular Weight:
242.2732
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$275
- +
1g
98%
In Stock USA
United States
$700
- +
5g
98%
In Stock USA
United States
$2100
- +
Product Description
Catalog Number:
AG00IGAW
Chemical Name:
tert-Butyl 3-cyano-1H-indole-1-carboxylate
CAS Number:
908244-43-9
Molecular Formula:
C14H14N2O2
Molecular Weight:
242.2732
MDL Number:
MFCD16037144
IUPAC Name:
tert-butyl 3-cyanoindole-1-carboxylate
InChI:
InChI=1S/C14H14N2O2/c1-14(2,3)18-13(17)16-9-10(8-15)11-6-4-5-7-12(11)16/h4-7,9H,1-3H3
InChI Key:
NAKDPGPBPQNLIA-UHFFFAOYSA-N
SMILES:
N#Cc1cn(c2c1cccc2)C(=O)OC(C)(C)C
Properties
Complexity:
377  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.106g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.278g/mol
Monoisotopic Mass:
242.106g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties