AG01C1U1

Name: 1-[(2-Bromoethyl)sulfanyl]ethan-1-one
Brand: Angene Chemical
SKU: AG01C1U1

927-70-8 | 1-[(2-Bromoethyl)sulfanyl]ethan-1-one

AG01C1U1

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CAS Number	927-70-8
Catalog Number	AG01C1U1(AGN-PC-0JSAYN)
Chemical Name	1-[(2-Bromoethyl)sulfanyl]ethan-1-one
IUPAC Name	S-(2-bromoethyl) ethanethioate
InChI	InChI=1S/C4H7BrOS/c1-4(6)7-3-2-5/h2-3H2,1H3
InChI Key	NYHLAZJBJZRGPV-UHFFFAOYSA-N
MDL Number	MFCD03005229
Molecular Formula	C4H7BrOS
Molecular Weight	183.0668
SMILES	C(C)(SCCBr)=O
Synonyms	927-70-8, S-acetyl-2-bromoethanethiol, 1-[(2-bromoethyl)sulfanyl]ethan-1-one, Ethanethioic acid, S-(2-bromoethyl) ester, AC1LAXPJ, S-bromoethyl thioacetate, Acetic acid, thio-, S-2-bromoethyl ester, 2-acetylthioethyl bromide, S-(2-bromoethyl) thioacetate, SCHEMBL2256202, S-(2-bromoethyl) ethanethioate, CTK3G9926, DTXSID40335141, NYHLAZJBJZRGPV-UHFFFAOYSA-N, ZINC5639445, Thioacetic acid S-(2-bromoethyl) ester, CID523036, Ethanethioicacid,S-(2-bromoethyl)ester,

Complexity	64.7
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	181.94g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	183.063g/mol
Monoisotopic Mass	181.94g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	42.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

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