AG002ZH6

Name: Thiocyanic acid, 2-oxopropyl ester
Brand: Angene Chemical
SKU: AG002ZH6

3029-48-9 | Thiocyanic acid, 2-oxopropyl ester

AG002ZH6

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CAS Number	3029-48-9
Catalog Number	AG002ZH6(AGN-PC-0NJ6KB)
Chemical Name	Thiocyanic acid, 2-oxopropyl ester
IUPAC Name	2-oxopropyl thiocyanate
InChI	InChI=1S/C4H5NOS/c1-4(6)2-7-3-5/h2H2,1H3
InChI Key	HBEQAYDPEJTYND-UHFFFAOYSA-N
MDL Number	MFCD11224898
Molecular Formula	C4H5NOS
Molecular Weight	115.1536
SMILES	CC(CSC#N)=O
Synonyms	3029-48-9, 1-(cyanosulfanyl)propan-2-one, 2-Oxopropyl thiocyanate, thiocyano-acetone, 1-thiocyanato-2-propanone, 1-Thiocyanatopropan-2-one, (2-oxopropyl)thiocarbonitrile, SCHEMBL1349370, CTK4G4811, DTXSID00500499, Thiocyanic acid,2-oxopropyl ester, Thiocyanic acid, 2-oxopropyl ester, ZINC16138990, AKOS022504420, MCULE-5774397655, ST51043955, Thiocyanic acid, 2-oxopropyl ester (9CI),

Complexity	112
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	115.009g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	115.15g/mol
Monoisotopic Mass	115.009g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	66.2A^2
Undefined Atom Stereocenter Count	1
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