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(3-chlorophenyl)(phenyl)methylurea

(3-chlorophenyl)(phenyl)methylurea

CAS: 117211-21-9

Formula: C14H13ClN2O

SMILES: NC(=O)NC(C1=CC=CC=C1)C1=CC(Cl)=CC=C1

IUPAC: [(3-chlorophenyl)(phenyl)methyl]urea

InChI: InChI=1/C14H13ClN2O/c15-12-8-4-7-11(9-12)13(17-14(16)18)10-5-2-1-3-6-10/h1-9,13H,(H3,16,17,18)

Composition: C (64.50%), H (5.03%), Cl (13.60%), N (10.74%), O (6.14%)

Molar Mass: 260.72

Atom Count: 31

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 260.0716407
Formal Charge 0
FSP3 0.07
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 2
InChIKey VQPUSIQKYOCUMK-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 71.74
Topological Polar Surface Area 55.12
Polarizability 27.8
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
95% <6 Days 117211-21-9 $477.25-$920.00$477.25$509.45$920.00
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