Home Carbonyls 3-(Methoxycarbonyl)-5-nitro-1H-pyrrole

3-(Methoxycarbonyl)-5-nitro-1H-pyrrole

CAS No.:
32116-27-1
Catalog Number:
AG00D0KO
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00D0KO
Chemical Name:
3-(Methoxycarbonyl)-5-nitro-1H-pyrrole
CAS Number:
32116-27-1
MDL Number:
MFCD09743412
IUPAC Name:
methyl 5-nitro-1H-pyrrole-3-carboxylate
InChI:
InChI=1S/C6H6N2O4/c1-12-6(9)4-2-5(7-3-4)8(10)11/h2-3,7H,1H3
InChI Key:
ZTWHUNPGEGHLDC-UHFFFAOYSA-N
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.033g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
170.124g/mol
Monoisotopic Mass:
170.033g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
87.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties