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4-benzoyl-N-[(methoxyimino)methyl]-1H-pyrrole-2-carboxamide

4-benzoyl-N-[(methoxyimino)methyl]-1H-pyrrole-2-carboxamide

CAS: 338977-04-1

Formula: C14H13N3O3

SMILES: CON=CNC(=O)C1=CC(=CN1)C(=O)C1=CC=CC=C1

IUPAC: 4-benzoyl-N-[(methoxyimino)methyl]-1H-pyrrole-2-carboxamide

InChI: InChI=1S/C14H13N3O3/c1-20-17-9-16-14(19)12-7-11(8-15-12)13(18)10-5-3-2-4-6-10/h2-9,15H,1H3,(H,16,17,19)

Composition: C (61.99%), H (4.83%), N (15.49%), O (17.69%)

Molar Mass: 271.276

Atom Count: 33

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 271.095691291
Formal Charge 0
FSP3 0.07
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey FTAQKPUGYQVEQC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 73.73
Topological Polar Surface Area 83.55
Polarizability 27.65
Ring Count 2
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 338977-04-1 $51.35-$86.31$51.35$63.37$86.31
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