Home Carboxys 5-Chloro-pyrrolo[2,3-b]pyridine-1-carboxylic acid tert-butyl ester

5-Chloro-pyrrolo[2,3-b]pyridine-1-carboxylic acid tert-butyl ester

CAS No.:
928653-82-1
Catalog Number:
AG00GSV6
Molecular Formula:
C12H13ClN2O2
Molecular Weight:
252.6968
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$400
- +
1g
95%
In Stock USA
United States
$1200
- +
Product Description
Catalog Number:
AG00GSV6
Chemical Name:
5-Chloro-pyrrolo[2,3-b]pyridine-1-carboxylic acid tert-butyl ester
CAS Number:
928653-82-1
Molecular Formula:
C12H13ClN2O2
Molecular Weight:
252.6968
MDL Number:
MFCD08741541
IUPAC Name:
tert-butyl 5-chloropyrrolo[2,3-b]pyridine-1-carboxylate
InChI:
InChI=1S/C12H13ClN2O2/c1-12(2,3)17-11(16)15-5-4-8-6-9(13)7-14-10(8)15/h4-7H,1-3H3
InChI Key:
SNGGZUPWFCDVAO-UHFFFAOYSA-N
SMILES:
Clc1cnc2c(c1)ccn2C(=O)OC(C)(C)C
Properties
Complexity:
303  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.067g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.698g/mol
Monoisotopic Mass:
252.067g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties