AG01AB25

Name: 1-(Tert-butylsulfanyl)propan-2-one
Brand: Angene Chemical
SKU: AG01AB25

85591-55-5 | 1-(Tert-butylsulfanyl)propan-2-one

AG01AB25

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CAS Number	85591-55-5
Catalog Number	AG01AB25(AGN-PC-008TM9)
Chemical Name	1-(Tert-butylsulfanyl)propan-2-one
IUPAC Name	1-tert-butylsulfanylpropan-2-one
InChI	InChI=1S/C7H14OS/c1-6(8)5-9-7(2,3)4/h5H2,1-4H3
InChI Key	YGCXECLDZCQMNI-UHFFFAOYSA-N
MDL Number	MFCD12145874
Molecular Formula	C7H14OS
Molecular Weight	146.2505
SMILES	CC(CSC(C)(C)C)=O
Synonyms	85591-55-5, 1-(tert-butylthio)propan-2-one, 1-(tert-butylsulfanyl)propan-2-one, 1-t-butylsulfenyl-2-propanone, (t-butylthio)acetone, AC1Q1K6K, 1-(t-Butylthio)propan-2-one, SCHEMBL3461929, YGCXECLDZCQMNI-UHFFFAOYSA-N, MFCD12145874, ZINC34545624, AKOS008954642, NE26668, AS-47988, EN300-70246, 1-tert-butylsulfanylpropan-2-one, CID11423669, 1-[(1,1-Dimethylethyl)thio]-2-propanone,

Complexity	102
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	146.077g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	146.248g/mol
Monoisotopic Mass	146.077g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	42.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

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