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902138-24-3 | Methyl 3-(4-Nitrophenyl)-1H-pyrrole-2-carboxylate
CAS No: 902138-24-3 Catalog No: AG01FLJA MDL No:
Product Description
Catalog Number:
AG01FLJA
Chemical Name:
Methyl 3-(4-Nitrophenyl)-1H-pyrrole-2-carboxylate
CAS Number:
902138-24-3
IUPAC Name:
methyl 3-(4-nitrophenyl)-1H-pyrrole-2-carboxylate
InChI:
InChI=1S/C12H10N2O4/c1-18-12(15)11-10(6-7-13-11)8-2-4-9(5-3-8)14(16)17/h2-7,13H,1H3
InChI Key:
VWIVHTAPBGSFBE-UHFFFAOYSA-N
Properties
Complexity:
321
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.064g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
246.222g/mol
Monoisotopic Mass:
246.064g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
87.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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