AG01DYFJ

Name: [(4-chlorobut-2-yn-1-yl)sulfanyl]carbonitrile
Brand: Angene Chemical
SKU: AG01DYFJ

113079-33-7 | [(4-chlorobut-2-yn-1-yl)sulfanyl]carbonitrile

AG01DYFJ

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CAS Number	113079-33-7
Catalog Number	AG01DYFJ(AGN-PC-0NHK8B)
Chemical Name	[(4-chlorobut-2-yn-1-yl)sulfanyl]carbonitrile
IUPAC Name	4-chlorobut-2-ynyl thiocyanate
InChI	InChI=1S/C5H4ClNS/c6-3-1-2-4-8-5-7/h3-4H2
InChI Key	SIVMBZMEIODFSN-UHFFFAOYSA-N
MDL Number	MFCD19233952
Molecular Formula	C5H4ClNS
Molecular Weight	145.6100
SMILES	ClCC#CCSC#N
Synonyms	[(4-chlorobut-2-yn-1-yl)sulfanyl]carbonitrile, 113079-33-7, SCHEMBL9803722, 1-chloro-4-thiocyanatobut-2-yne, AKOS006382069,

Complexity	155
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	144.975g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	145.604g/mol
Monoisotopic Mass	144.975g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	49.1A^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