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1-(4-chloro-2-methylphenyl)-3-(oxolan-2-ylmethyl)thiourea

1-(4-chloro-2-methylphenyl)-3-(oxolan-2-ylmethyl)thiourea

Formula: C13H17ClN2OS

SMILES: CC1=CC(Cl)=CC=C1NC(=S)NCC1CCCO1

IUPAC: 1-(4-chloro-2-methylphenyl)-3-[(oxolan-2-yl)methyl]thiourea

InChI: InChI=1/C13H17ClN2OS/c1-9-7-10(14)4-5-12(9)16-13(18)15-8-11-3-2-6-17-11/h4-5,7,11H,2-3,6,8H2,1H3,(H2,15,16,18)

Composition: C (54.83%), H (6.02%), Cl (12.45%), N (9.84%), O (5.62%), S (11.26%)

Molar Mass: 284.8

Atom Count: 35

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 284.075012
Formal Charge 0
FSP3 0.46
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 2
InChIKey ABOZFPRFNUKBLL-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 80.59
Topological Polar Surface Area 33.29
Polarizability 30.67
Ring Count 2
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C13H17ClN2OS $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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