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2,4-difluorophenylthiourea

2,4-difluorophenylthiourea

CAS: 175277-76-6

Formula: C7H6F2N2S

SMILES: NC(=S)NC1=CC=C(F)C=C1F

IUPAC: (2,4-difluorophenyl)thiourea

InChI: InChI=1S/C7H6F2N2S/c8-4-1-2-6(5(9)3-4)11-7(10)12/h1-3H,(H3,10,11,12)

Composition: C (44.68%), H (3.21%), F (20.19%), N (14.89%), S (17.04%)

Molar Mass: 188.2

Atom Count: 18

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 188.021975701
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 2
InChIKey DZZSKQFBAGZNSH-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 48.02
Topological Polar Surface Area 38.05
Polarizability 17.26
Ring Count 1
Rotatable Bond Count 1

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