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2,4-dichloro-N-pentylbenzamide

2,4-dichloro-N-pentylbenzamide

CAS: 2447-88-3

Formula: C12H15Cl2NO

SMILES: CCCCCNC(=O)C1=CC=C(Cl)C=C1Cl

IUPAC: 2,4-dichloro-N-pentylbenzamide

InChI: InChI=1S/C12H15Cl2NO/c1-2-3-4-7-15-12(16)10-6-5-9(13)8-11(10)14/h5-6,8H,2-4,7H2,1H3,(H,15,16)

Composition: C (55.40%), H (5.81%), Cl (27.25%), N (5.38%), O (6.15%)

Molar Mass: 260.16

Atom Count: 31

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 259.0530695
Formal Charge 0
FSP3 0.42
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey QLFOKAOJSCZXRM-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 68.12
Topological Polar Surface Area 29.1
Polarizability 26.15
Ring Count 1
Rotatable Bond Count 5

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