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3-(5-bromo-2-chlorobenzoyl)-1-(2-chloro-4-iodophenyl)thiourea

3-(5-bromo-2-chlorobenzoyl)-1-(2-chloro-4-iodophenyl)thiourea

Formula: C14H8BrCl2IN2OS

SMILES: ClC1=CC(I)=CC=C1NC(=S)NC(=O)C1=CC(Br)=CC=C1Cl

IUPAC: 3-(5-bromo-2-chlorobenzoyl)-1-(2-chloro-4-iodophenyl)thiourea

InChI: InChI=1S/C14H8BrCl2IN2OS/c15-7-1-3-10(16)9(5-7)13(21)20-14(22)19-12-4-2-8(18)6-11(12)17/h1-6H,(H2,19,20,21,22)

Composition: C (31.73%), H (1.52%), Br (15.08%), Cl (13.38%), I (23.94%), N (5.29%), O (3.02%), S (6.05%)

Molar Mass: 530

Atom Count: 30

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 527.79625
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 2
InChIKey RSKPBQNDBBOEQQ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 108.42
Topological Polar Surface Area 41.13
Polarizability 41.11
Ring Count 2
Rotatable Bond Count 2

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C14H8BrCl2IN2OS $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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