AG00IDE2

Name: 1-(2,2,2-Trifluoroethyl)thiourea
Brand: Angene Chemical
SKU: AG00IDE2

84545-31-3 | 1-(2,2,2-Trifluoroethyl)thiourea

AG00IDE2

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CAS Number	84545-31-3
Catalog Number	AG00IDE2(AGN-PC-02O8K0)
Chemical Name	1-(2,2,2-Trifluoroethyl)thiourea
IUPAC Name	2,2,2-trifluoroethylthiourea
InChI	InChI=1S/C3H5F3N2S/c4-3(5,6)1-8-2(7)9/h1H2,(H3,7,8,9)
InChI Key	OMUMOOLRHXALLM-UHFFFAOYSA-N
MDL Number	MFCD10691447
Molecular Formula	C3H5F3N2S
Molecular Weight	158.1454
SMILES	NC(NCC(F)(F)F)=S
Synonyms	1-(2,2,2-Trifluoroethyl)thiourea, (2,2,2-trifluoroethyl)thiourea, 84545-31-3, trifluoroethyl thiourea, 2,2,2-trifluoroethylthiourea, C3H5F3N2S, 2,2,2-Trifluoroethyl-thiourea, AC1Q503O, SCHEMBL2580446, CTK7D3983, OMUMOOLRHXALLM-UHFFFAOYSA-N, N-(2,2,2-Trifluoroethyl)thiourea, 8437AH, ZINC26515534, Thiourea, (2,2,2-trifluoroethyl)-, AKOS009159524, NE55199, AJ-82557, EN300-49921,

Complexity	110
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	158.013g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	158.142g/mol
Monoisotopic Mass	158.013g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	70.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited