AG003S88

6590-91-6 | (2,6-dichlorophenyl)thiourea

AG003S88

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CAS Number	6590-91-6
Catalog Number	AG003S88(AGN-PC-0JVGPB)
Chemical Name	(2,6-dichlorophenyl)thiourea
IUPAC Name	(2,6-dichlorophenyl)thiourea
InChI	InChI=1S/C7H6Cl2N2S/c8-4-2-1-3-5(9)6(4)11-7(10)12/h1-3H,(H3,10,11,12)
InChI Key	KUQHRGMPBWZVQR-UHFFFAOYSA-N
MDL Number	MFCD00041156
Molecular Formula	C7H6Cl2N2S
Molecular Weight	221.1069
SMILES	S=C(N)NC1=C(Cl)C=CC=C1Cl
Synonyms	6590-91-6, 2,6-DICHLOROPHENYLTHIOUREA, 1-(2,6-Dichlorophenyl)thiourea, (2,6-dichlorophenyl)thiourea, N-(2,6-dichlorophenyl)thiourea, Thiourea, (2,6-dichlorophenyl)-, 1-(2,6-Dichlorophenyl)-2-thiourea, MFCD00041156, amino[(2,6-dichlorophenyl)amino]methane-1-thione, AI3-63140, AC1LF4AT, 2,6-dichlorophenyl thiourea, MLS000835022, CHEMBL29234, (2,6-dichlorophenyl)-thiourea, SCHEMBL3264509, CTK5C3250, DTXSID90216113, KUQHRGMPBWZVQR-UHFFFAOYSA-N, HMS2782D11, KS-000029XC, Thiourea,N-(2,6-dichlorophenyl)-, 7555AE, CD-761, KM0969, SBB055212, ZINC13657236, AKOS005203003, 1-[2,6-bis(chloranyl)phenyl]thiourea, AN-6172, AS02414, CCG-256079, MCULE-6793857275, PS-3403, VZ34442, N-(2,6-Dichlorophenyl)thiourea, 99%, NCGC00246707-01, SMR000461638, FT-0610627, ST50825717, A835272, I14-110439, C7H6Cl2N2S, C7-H6-Cl2-N2-S, CID722776, ZINC00127101,

Complexity	167
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	219.963g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	221.099g/mol
Monoisotopic Mass	219.963g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	70.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
UN Code

Certificate of Analysis

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