Home Carboxys tert-Butyl 2H,3H-pyrrolo[2,3-b]pyridine-1-carboxylate

tert-Butyl 2H,3H-pyrrolo[2,3-b]pyridine-1-carboxylate

CAS No.:
679392-21-3
Catalog Number:
AG00FGYO
Molecular Formula:
C12H16N2O2
Molecular Weight:
220.2676
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$313
- +
5g
97%
In Stock USA
United States
$938
- +
Product Description
Catalog Number:
AG00FGYO
Chemical Name:
tert-Butyl 2H,3H-pyrrolo[2,3-b]pyridine-1-carboxylate
CAS Number:
679392-21-3
Molecular Formula:
C12H16N2O2
Molecular Weight:
220.2676
MDL Number:
MFCD24448824
IUPAC Name:
tert-butyl 2,3-dihydropyrrolo[2,3-b]pyridine-1-carboxylate
InChI:
InChI=1S/C12H16N2O2/c1-12(2,3)16-11(15)14-8-6-9-5-4-7-13-10(9)14/h4-5,7H,6,8H2,1-3H3
InChI Key:
WLOMDLSRFNCYNR-UHFFFAOYSA-N
SMILES:
O=C(N1CCc2c1nccc2)OC(C)(C)C
Properties
Complexity:
273  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.121g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.272g/mol
Monoisotopic Mass:
220.121g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties