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benzyl({[5-chloro-2-(prop-2-en-1-yloxy)phenyl]methyl})amine

benzyl({[5-chloro-2-(prop-2-en-1-yloxy)phenyl]methyl})amine

Formula: C17H18ClNO

SMILES: ClC1=CC=C(OCC=C)C(CNCC2=CC=CC=C2)=C1

IUPAC: benzyl({[5-chloro-2-(prop-2-en-1-yloxy)phenyl]methyl})amine

InChI: InChI=1S/C17H18ClNO/c1-2-10-20-17-9-8-16(18)11-15(17)13-19-12-14-6-4-3-5-7-14/h2-9,11,19H,1,10,12-13H2

Composition: C (70.95%), H (6.30%), Cl (12.32%), N (4.87%), O (5.56%)

Molar Mass: 287.79

Atom Count: 38

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 287.1076919
Formal Charge 0
FSP3 0.18
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey YTTZNPNWPAAGMA-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 84.35
Topological Polar Surface Area 21.26
Polarizability 32.96
Ring Count 2
Rotatable Bond Count 7

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C17H18ClNO $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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