AG01DTTS

Name: Methyl 4-(cyanomethyl)thiophene-2-carboxylate
Brand: Angene Chemical
SKU: AG01DTTS

878741-67-4 | Methyl 4-(cyanomethyl)thiophene-2-carboxylate

AG01DTTS

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CAS Number	878741-67-4
Catalog Number	AG01DTTS(AGN-PC-080U2X)
Chemical Name	Methyl 4-(cyanomethyl)thiophene-2-carboxylate
IUPAC Name	methyl 4-(cyanomethyl)thiophene-2-carboxylate
InChI	InChI=1S/C8H7NO2S/c1-11-8(10)7-4-6(2-3-9)5-12-7/h4-5H,2H2,1H3
InChI Key	VGNQIBJZCTXQPN-UHFFFAOYSA-N
MDL Number	MFCD17215389
Molecular Formula	C8H7NO2S
Molecular Weight	181.2117
SMILES	COC(=O)C1=CC(CC#N)=CS1
Synonyms	methyl 4-(cyanomethyl)thiophene-2-carboxylate, 878741-67-4, SCHEMBL4208760, MFCD17215389, AKOS015898830, AS-48480, CS-0030350, I09-1940, S09-0147,

Complexity	220
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	181.02g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	181.209g/mol
Monoisotopic Mass	181.02g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	78.3A^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