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3-(dipropylamino)propyl 2,4-dichlorobenzoate

3-(dipropylamino)propyl 2,4-dichlorobenzoate

Formula: C16H23Cl2NO2

SMILES: CCCN(CCC)CCCOC(=O)C1=CC=C(Cl)C=C1Cl

IUPAC: 3-(dipropylamino)propyl 2,4-dichlorobenzoate

InChI: InChI=1S/C16H23Cl2NO2/c1-3-8-19(9-4-2)10-5-11-21-16(20)14-7-6-13(17)12-15(14)18/h6-7,12H,3-5,8-11H2,1-2H3

Composition: C (57.84%), H (6.98%), Cl (21.34%), N (4.22%), O (9.63%)

Molar Mass: 332.27

Atom Count: 44

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 331.1105844
Formal Charge 0
FSP3 0.56
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey OJIYCKBQGMYSRY-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 89.12
Topological Polar Surface Area 29.54
Polarizability 34.78
Ring Count 1
Rotatable Bond Count 10

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C16H23Cl2NO2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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