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Home > Aldehydes > 107484-34-4
107484-34-4 | 1H-Pyrrole-2-carboxaldehyde, 1-[(4-nitrophenyl)methyl]-
CAS No: 107484-34-4 Catalog No: AG0084OT MDL No:
Product Description
Catalog Number:
AG0084OT
Chemical Name:
1H-Pyrrole-2-carboxaldehyde, 1-[(4-nitrophenyl)methyl]-
CAS Number:
107484-34-4
Molecular Formula:
C12H10N2O3
Molecular Weight:
230.2194
IUPAC Name:
1-[(4-nitrophenyl)methyl]pyrrole-2-carbaldehyde
InChI:
InChI=1S/C12H10N2O3/c15-9-12-2-1-7-13(12)8-10-3-5-11(6-4-10)14(16)17/h1-7,9H,8H2
InChI Key:
WRYZZFHVGAKORA-UHFFFAOYSA-N
SMILES:
O=Cc1cccn1Cc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.069g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.223g/mol
Monoisotopic Mass:
230.069g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
67.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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