Home Halogens tert-Butyl 3-bromo-5h-pyrrolo[3,4-b]pyridine-6(7h)-carboxylate

tert-Butyl 3-bromo-5h-pyrrolo[3,4-b]pyridine-6(7h)-carboxylate

CAS No.:
1393546-06-9
Catalog Number:
AG001ATH
Molecular Formula:
C12H15BrN2O2
Molecular Weight:
299.1637
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$603
- +
1g
97%
1 week
United States
$981
- +
Product Description
Catalog Number:
AG001ATH
Chemical Name:
tert-Butyl 3-bromo-5h-pyrrolo[3,4-b]pyridine-6(7h)-carboxylate
CAS Number:
1393546-06-9
Molecular Formula:
C12H15BrN2O2
Molecular Weight:
299.1637
MDL Number:
MFCD22544061
IUPAC Name:
tert-butyl 3-bromo-5,7-dihydropyrrolo[3,4-b]pyridine-6-carboxylate
InChI:
InChI=1S/C12H15BrN2O2/c1-12(2,3)17-11(16)15-6-8-4-9(13)5-14-10(8)7-15/h4-5H,6-7H2,1-3H3
InChI Key:
XNYFHOLKXKTKIG-UHFFFAOYSA-N
SMILES:
Brc1cnc2c(c1)CN(C2)C(=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:
298.032g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
299.168g/mol
Monoisotopic Mass:
298.032g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties