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(2E)-3-(3,4-dichlorophenyl)-N-(sec-butyl)prop-2-enamide

(2E)-3-(3,4-dichlorophenyl)-N-(sec-butyl)prop-2-enamide

CAS: 82351-05-1

Formula: C13H15Cl2NO

SMILES: CCC(C)NC(=O)\C=C\C1=CC=C(Cl)C(Cl)=C1

IUPAC: (2E)-N-(butan-2-yl)-3-(3,4-dichlorophenyl)prop-2-enamide

InChI: InChI=1/C13H15Cl2NO/c1-3-9(2)16-13(17)7-5-10-4-6-11(14)12(15)8-10/h4-9H,3H2,1-2H3,(H,16,17)/b7-5+

Composition: C (57.37%), H (5.56%), Cl (26.05%), N (5.15%), O (5.88%)

Molar Mass: 272.17

Atom Count: 32

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 271.0530695
Formal Charge 0
FSP3 0.31
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey WMHSFCNWWYFBSS-FNORWQNLNA-N
Lipinski's Rule of Five 1
Molar Refractivity 73.08
Topological Polar Surface Area 29.1
Polarizability 27.95
Ring Count 1
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
99.48% <7 Days 82351-05-1 $84.15-$261.80$84.15$130.90$261.80
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