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5-bromo-N-butyl-2-chlorobenzamide

5-bromo-N-butyl-2-chlorobenzamide

CAS: 1184623-42-4

Formula: C11H13BrClNO

SMILES: CCCCNC(=O)C1=CC(Br)=CC=C1Cl

IUPAC: 5-bromo-N-butyl-2-chlorobenzamide

InChI: InChI=1S/C11H13BrClNO/c1-2-3-6-14-11(15)9-7-8(12)4-5-10(9)13/h4-5,7H,2-3,6H2,1H3,(H,14,15)

Composition: C (45.47%), H (4.51%), Br (27.50%), Cl (12.20%), N (4.82%), O (5.51%)

Molar Mass: 290.59

Atom Count: 28

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 288.986905
Formal Charge 0
FSP3 0.36
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey ZZAQYLFNWXPSAG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 66.33
Topological Polar Surface Area 29.1
Polarizability 25.26
Ring Count 1
Rotatable Bond Count 4

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Purity (%)
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Purity LeadTime CAS PacketSize UnitPrice
98% <6 Days 1184623-42-4 $218.50-$952.20$218.50$409.40$952.20
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