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AG002ZZD

30399-84-9 | 16-methylheptadecanoic acid

AG002ZZD

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CAS Number	30399-84-9
Catalog Number	AG002ZZD(AGN-PC-0WADJE)
Chemical Name	16-methylheptadecanoic acid
IUPAC Name	16-methylheptadecanoic acid
InChI	InChI=1S/C18H36O2/c1-17(2)15-13-11-9-7-5-3-4-6-8-10-12-14-16-18(19)20/h17H,3-16H2,1-2H3,(H,19,20)
InChI Key	XDOFQFKRPWOURC-UHFFFAOYSA-N
MDL Number	MFCD00044082
Molecular Formula	C18H36O2
Molecular Weight	284.4772
SMILES	C(CCCCCCCCCCCCCCC(C)C)(=O)O
UNII	LZM5XA0ILL
Synonyms	2-methyl-heptadecanoic acid, isostearate, isostearic acid, ISOSTEARIC ACID, Isooctadecanoic acid, 16-METHYLHEPTADECANOIC ACID, 2724-58-5, 30399-84-9, (+)-Isostearic acid, UNII-LZM5XA0ILL, 16-methyl-heptadecanoic acid, Heptadecanoic acid, 16-methyl-, LZM5XA0ILL, 16-methyl margaric acid, EINECS 220-336-3, CHEBI:84896, W-109211, Prisorine 3509, 16-methylmargaric acid, DSSTox_CID_7963, AC1L2J8P, DSSTox_RID_78624, DSSTox_GSID_27963, SCHEMBL15489, KSC223A3R, CHEMBL1865303, DTXSID1040790, CTK1C3038, XDOFQFKRPWOURC-UHFFFAOYSA-N, ZINC4556536, Tox21_302276, LMFA01020014, MFCD00044082, AKOS027320244, ACM2724585, NCGC00164392-01, NCGC00164392-02, NCGC00255115-01, Isostearic acid, >=97% (capillary GC), LS-74183, CAS-30399-84-9, C20356, J-016709, UNII-D1CZ545P7Z component XDOFQFKRPWOURC-UHFFFAOYSA-N, UNII-X33R8U0062 component XDOFQFKRPWOURC-UHFFFAOYSA-N, Isostearic acid EX, Haimaric MKH(R), Prisorine 3501, Prisorine 3502, Prisorine 3508, Emersol 871, Emersol 875, ISOSTEARICACID, lambda-Isostearic acid, Emery 875D, Emery 871, Unimac 5680, UNII-X33R8U0062, C18H36O2, CID21859, EINECS 250-178-0, C18-H36-O2, 875D, FA(18:0), EC 250-178-0, 22890-21-7, ISA,

Complexity	212
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	284.272g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	284.484g/mol
Monoisotopic Mass	284.272g/mol
Rotatable Bond Count	15
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	7.2

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CERTIFICATE OF ANALYSIS

Chemical Name:	Batch Number:
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Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited

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