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Home Carboxys tert-Butyl 1,3-dioxopyrrolo[3,4-c]pyridine-2-carboxylate

tert-Butyl 1,3-dioxopyrrolo[3,4-c]pyridine-2-carboxylate

CAS No.:
1824170-57-1
Catalog Number:
AG00I1DD
Molecular Formula:
C12H12N2O4
Molecular Weight:
248.2347
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$188
- +
5g
96%
In Stock USA
United States
$700
- +
Product Description
Catalog Number:
AG00I1DD
Chemical Name:
tert-Butyl 1,3-dioxopyrrolo[3,4-c]pyridine-2-carboxylate
CAS Number:
1824170-57-1
Molecular Formula:
C12H12N2O4
Molecular Weight:
248.2347
MDL Number:
MFCD24474950
IUPAC Name:
tert-butyl 1,3-dioxopyrrolo[3,4-c]pyridine-2-carboxylate
InChI:
InChI=1S/C12H12N2O4/c1-12(2,3)18-11(17)14-9(15)7-4-5-13-6-8(7)10(14)16/h4-6H,1-3H3
InChI Key:
MLRUXAIJTMBAAH-UHFFFAOYSA-N
SMILES:
O=C(N1C(=O)c2c(C1=O)cncc2)OC(C)(C)C
Properties
Complexity:
399  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.08g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.238g/mol
Monoisotopic Mass:
248.08g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
76.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties