AG00I31X

Name: Benzyl 2-methyl-2-(methylsulfonyl)pent-4-enoate
Brand: Angene Chemical
SKU: AG00I31X

1942858-50-5 | Benzyl 2-methyl-2-(methylsulfonyl)pent-4-enoate

AG00I31X

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CAS Number	1942858-50-5
Catalog Number	AG00I31X(AGN-PC-0WNGNG)
Chemical Name	Benzyl 2-methyl-2-(methylsulfonyl)pent-4-enoate
IUPAC Name	benzyl 2-methyl-2-methylsulfonylpent-4-enoate
InChI	InChI=1S/C14H18O4S/c1-4-10-14(2,19(3,16)17)13(15)18-11-12-8-6-5-7-9-12/h4-9H,1,10-11H2,2-3H3
InChI Key	IWUXUMPMYUOEIY-UHFFFAOYSA-N
MDL Number	MFCD30530547
Molecular Formula	C14H18O4S
Molecular Weight	282.3553
SMILES	CC(CC=C)(C(=O)OCC1=CC=CC=C1)S(C)(=O)=O
Synonyms	benzyl 2-methyl-2-(methylsulfonyl)pent-4-enoate, 1942858-50-5, MFCD30530547, AKOS030633045, CS-W018403, KS-00000U88, AK680459, DS-20059, benzyl 2-methyl-2-methylsulfonylpent-4-enoate, benzyl (2R)-2-methyl-2-methylsulfonylpent-4-enoate, benzyl (2S)-2-methyl-2-methylsulfonylpent-4-enoate, 1821022-18-7, 1942858-51-6,

Complexity	415
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	282.093g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	282.354g/mol
Monoisotopic Mass	282.093g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	68.8A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.3

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