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Home Halogens t-Butyl 4-chloropyrrolo[2,3-d]pyrimidine-7-carboxylate

t-Butyl 4-chloropyrrolo[2,3-d]pyrimidine-7-carboxylate

CAS No.:
1236033-21-8
Catalog Number:
AG00HHCI
Molecular Formula:
C11H12ClN3O2
Molecular Weight:
253.6849
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
In Stock USA
United States
$69
- +
1g
97%
In Stock USA
United States
$113
- +
5g
97%
In Stock USA
United States
$338
- +
25g
97%
In Stock USA
United States
$1013
- +
Product Description
Catalog Number:
AG00HHCI
Chemical Name:
t-Butyl 4-chloropyrrolo[2,3-d]pyrimidine-7-carboxylate
CAS Number:
1236033-21-8
Molecular Formula:
C11H12ClN3O2
Molecular Weight:
253.6849
MDL Number:
MFCD18427890
IUPAC Name:
tert-butyl 4-chloropyrrolo[2,3-d]pyrimidine-7-carboxylate
InChI:
InChI=1S/C11H12ClN3O2/c1-11(2,3)17-10(16)15-5-4-7-8(12)13-6-14-9(7)15/h4-6H,1-3H3
InChI Key:
XGGUTWYJGILAOA-UHFFFAOYSA-N
SMILES:
O=C(n1ccc2c1ncnc2Cl)OC(C)(C)C
Properties
Complexity:
306  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.062g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.686g/mol
Monoisotopic Mass:
253.062g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties