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2-[(2-chloro-4-iodophenyl)amino]-N-(cyclopropylmethoxy)-3,4-difluorobenzamide

2-[(2-chloro-4-iodophenyl)amino]-N-(cyclopropylmethoxy)-3,4-difluorobenzamide

CAS: 212631-79-3

Formula: C17H14ClF2IN2O2

SMILES: FC1=CC=C(C(=O)NOCC2CC2)C(NC2=CC=C(I)C=C2Cl)=C1F

IUPAC: 2-[(2-chloro-4-iodophenyl)amino]-N-(cyclopropylmethoxy)-3,4-difluorobenzamide

InChI: InChI=1S/C17H14ClF2IN2O2/c18-12-7-10(21)3-6-14(12)22-16-11(4-5-13(19)15(16)20)17(24)23-25-8-9-1-2-9/h3-7,9,22H,1-2,8H2,(H,23,24)

Composition: C (42.66%), H (2.95%), Cl (7.41%), F (7.94%), I (26.51%), N (5.85%), O (6.68%)

Molar Mass: 478.66

Atom Count: 39

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 477.97566
Formal Charge 0
FSP3 0.24
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey GFMMXOIFOQCCGU-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 100.41
Topological Polar Surface Area 50.36
Polarizability 37.91
Ring Count 3
Rotatable Bond Count 6

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Molnova Chemicals
Purity LeadTime CAS PacketSize UnitPrice
98% <4 Days 212631-79-3 $36.69-$368.44$36.69$58.86$114.66$176.58$294.29$368.44
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