AG0001IM

Name: thian-2-one
Brand: Angene Chemical
SKU: AG0001IM

1003-42-5 | thian-2-one

AG0001IM

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CAS Number	1003-42-5
Catalog Number	AG0001IM(AGN-PC-0NDF0W)
Chemical Name	thian-2-one
IUPAC Name	thian-2-one
InChI	InChI=1S/C5H8OS/c6-5-3-1-2-4-7-5/h1-4H2
InChI Key	CFFCKUISNHPWOW-UHFFFAOYSA-N
MDL Number	MFCD22054117
Molecular Formula	C5H8OS
Molecular Weight	116.1814
SMILES	O=C1SCCCC1
Synonyms	Thian-2-one, 1003-42-5, tetrahydrothiopyran-2-one, Tetrahydro-2H-thiopyran-2-one, 2H-Thiopyran-2-one, tetrahydro-, 2-thiacyclohexanone, SCHEMBL1024355, CTK0G8917, DTXSID20449477, ZINC13532942, AKOS030537831, Z2754447865, CID10953473,

Complexity	80.1
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	116.03g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	116.178g/mol
Monoisotopic Mass	116.03g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	42.4A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.1

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