AG01EOA6

Name: 4-Octyl Itaconate
Brand: Angene Chemical
SKU: AG01EOA6

3133-16-2 | 4-Octyl Itaconate

AG01EOA6

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COA

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WARNING This product is not for human or veterinary use.

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CAS Number	3133-16-2
Catalog Number	AG01EOA6(AGN-PC-0JD4M6)
Chemical Name	4-Octyl Itaconate
IUPAC Name	2-methylidene-4-octoxy-4-oxobutanoic acid
InChI	InChI=1S/C13H22O4/c1-3-4-5-6-7-8-9-17-12(14)10-11(2)13(15)16/h2-10H2,1H3,(H,15,16)
InChI Key	KBASUIDPDITQHT-UHFFFAOYSA-N
MDL Number	MFCD31706409
Molecular Formula	C13H22O4
Molecular Weight	242.3114
SMILES	O=C(O)C(=C)CC(=O)OCCCCCCCC
Synonyms	4-Octyl Itaconate, 3133-16-2, 4-octyl-Itaconate, Itaconic acid 4-octyl ester, SCHEMBL3681702, HY-112675, AK00807135, CS-0062483, OI,

Complexity	258
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	242.152g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	242.315g/mol
Monoisotopic Mass	242.152g/mol
Rotatable Bond Count	11
Topological Polar Surface Area	63.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.6

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