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3-(6-chlorohexyl)-1-(2-methylphenyl)urea

3-(6-chlorohexyl)-1-(2-methylphenyl)urea

Formula: C14H21ClN2O

SMILES: CC1=CC=CC=C1NC(=O)NCCCCCCCl

IUPAC: 3-(6-chlorohexyl)-1-(2-methylphenyl)urea

InChI: InChI=1S/C14H21ClN2O/c1-12-8-4-5-9-13(12)17-14(18)16-11-7-3-2-6-10-15/h4-5,8-9H,2-3,6-7,10-11H2,1H3,(H2,16,17,18)

Composition: C (62.56%), H (7.88%), Cl (13.19%), N (10.42%), O (5.95%)

Molar Mass: 268.79

Atom Count: 39

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 268.134241
Formal Charge 0
FSP3 0.5
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 2
InChIKey AIYCNWDPNSFEMK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 77.59
Topological Polar Surface Area 41.13
Polarizability 29.13
Ring Count 1
Rotatable Bond Count 7

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C14H21ClN2O $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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