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1-(butylamino)-3-(4-chloro-3-methylphenoxy)propan-2-ol

1-(butylamino)-3-(4-chloro-3-methylphenoxy)propan-2-ol

Formula: C14H22ClNO2

SMILES: CCCCNCC(O)COC1=CC=C(Cl)C(C)=C1

IUPAC: 1-(butylamino)-3-(4-chloro-3-methylphenoxy)propan-2-ol

InChI: InChI=1/C14H22ClNO2/c1-3-4-7-16-9-12(17)10-18-13-5-6-14(15)11(2)8-13/h5-6,8,12,16-17H,3-4,7,9-10H2,1-2H3

Composition: C (61.87%), H (8.16%), Cl (13.04%), N (5.15%), O (11.77%)

Molar Mass: 271.79

Atom Count: 40

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 271.1339067
Formal Charge 0
FSP3 0.57
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey FFULVJAIHOSFLK-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 74.93
Topological Polar Surface Area 41.49
Polarizability 29.66
Ring Count 1
Rotatable Bond Count 8

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C14H22ClNO2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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