AG00DBSG

Name: Phenacyl thiocyanate
Brand: Angene Chemical
SKU: AG00DBSG

5399-30-4 | Phenacyl thiocyanate

AG00DBSG

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COA

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WARNING This product is not for human or veterinary use.

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CAS Number	5399-30-4
Catalog Number	AG00DBSG(AGN-PC-0JN9Q9)
Chemical Name	Phenacyl thiocyanate
IUPAC Name	phenacyl thiocyanate
InChI	InChI=1S/C9H7NOS/c10-7-12-6-9(11)8-4-2-1-3-5-8/h1-5H,6H2
InChI Key	DLLVIJACDVJDIP-UHFFFAOYSA-N
MDL Number	MFCD00019769
Molecular Formula	C9H7NOS
Molecular Weight	177.2230
NSC Number	1346
SMILES	O=C(C1=CC=CC=C1)CSC#N
Synonyms	Phenacyl thiocyanate, 5399-30-4, 2-Oxo-2-phenylethyl thiocyanate, 1-phenyl-2-thiocyanatoethanone, 1-Phenyl-2-thiocyanato-ethanone, 2-(cyanosulfanyl)-1-phenylethan-1-one, DLLVIJACDVJDIP-UHFFFAOYSA-N, Thiocyanic acid,2-oxo-2-phenylethyl ester, (2-oxo-2-phenylethyl)thiocarbonitrile, PHENACYLTHIOCYANATE, PubChem12899, Thiocyanato-acetophenone, AC1Q5HMU, Bio2C11, Maybridge3_001219, alpha-Thiocyanoacetophenone, omega-thiocyano acetophenone, AC1L57AU, Cambridge id 5150763, SCHEMBL955563, AC1Q5F75, CTK4J9245, DTXSID70277242, NSC1346, HMS1434H09, 1-phenyl-2-thiocyanatoethan-1-one, 2-Oxo-2-phenylethyl thiocyanate #, ALBB-031708, NSC-1346, ZINC1576772, FCH920084, MFCD00019769, SBB079019, AKOS005142967, AB01264, MCULE-4305762856, THIOCYANIC ACID, PHENACYL ESTER, IDI1_012606, AJ-27333, CC-33612, CJ-24962, NS-01503, DB-001811, Thiocyanic acid, 2-oxo-2-phenylethyl ester, FT-0603672, ST50545972, 399P304, AE-534/30091043, C-06279, F8889-7776, AR-1E4634, CID219693, 6122-46-9,

Complexity	200
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	177.025g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	177.221g/mol
Monoisotopic Mass	177.025g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	66.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

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