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AG002CWW

Name: 4-[3-(Trifluoromethyl)phenyl]-3-thiosemicarbazide
Brand: Angene Chemical
SKU: AG002CWW

20069-30-1 | 4-[3-(Trifluoromethyl)phenyl]-3-thiosemicarbazide

Chemical structure of 4-[3-(Trifluoromethyl)phenyl]-3-thiosemicarbazide, CAS 20069-30-1

AG002CWW

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CAS Number	20069-30-1
Catalog Number	AG002CWW(AGN-PC-0JVOVH)
Chemical Name	4-[3-(Trifluoromethyl)phenyl]-3-thiosemicarbazide
IUPAC Name	1-amino-3-[3-(trifluoromethyl)phenyl]thiourea
InChI	InChI=1S/C8H8F3N3S/c9-8(10,11)5-2-1-3-6(4-5)13-7(15)14-12/h1-4H,12H2,(H2,13,14,15)
InChI Key	KDDAUQBQXBHUPJ-UHFFFAOYSA-N
MDL Number	MFCD00041291
Molecular Formula	C8H8F3N3S
Molecular Weight	235.2294
SMILES	NNC(NC1=CC(C(F)(F)F)=CC=C1)=S
Synonyms	20069-30-1, 4-[3-(Trifluoromethyl)phenyl]-3-thiosemicarbazide, N-(3-(Trifluoromethyl)phenyl)hydrazinecarbothioamide, n-[3-(trifluoromethyl)phenyl]hydrazinecarbothioamide, CHEMBL3286598, MFCD00041291, 1-amino-3-[3-(trifluoromethyl)phenyl]thiourea, 3-amino-1-[3-(trifluoromethyl)phenyl]thiourea, Hydrazinecarbothioamide,N-[3-(trifluoromethyl)phenyl]-, 4-(3-(trifluoromethyl)phenyl)-3-thiosemicarbazide, AC1LEKGR, ACMC-1CPVA, AC1Q7EJB, Maybridge1_000964, SCHEMBL2467470, CTK4E3206, HMS544D18, DTXSID10353251, KDDAUQBQXBHUPJ-UHFFFAOYSA-N, ZINC167746, ZX-AP008166, 6768AD, BDBM50019766, PC8316, SBB098398, STL181357, AKOS001045017, CCG-244038, MCULE-8026247504, NE51440, ACM20069301, TR-009347, FT-0617349, EN300-08159, 1-azanyl-3-[3-(trifluoromethyl)phenyl]thiourea, A814216, SR-01000037983, I09-2777, SR-01000037983-1, Hydrazinecarbothioamide, N-[3-(trifluoromethyl)phenyl]-, N-[3-(trifluoromethyl)phenyl]-1-hydrazinecarbothioamide, 4-(alpha,alpha,alpha-Trifluoro-m-tolyl)-3-thiosemicarbazide, hydrazino{[3-(trifluoromethyl)phenyl]amino}methane-1-thione, C8H8F3N3S, AR-1K3934, CID737504, ZINC00167746, 21633-59-0,

Complexity	232
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	235.039g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	235.228g/mol
Monoisotopic Mass	235.039g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	82.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301
Packing Group	Ⅲ
Precautionary statements	P264-P270-P301+P310-P330-P405-P501
UN Code	UN 2811

Related Research Chemicals

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Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

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Reviewed by:Jessie

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Angene International Limited