AG006YB6

14246-53-8 | 2-Octanamidoacetic acid

AG006YB6

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CAS Number	14246-53-8
Catalog Number	AG006YB6(AGN-PC-0JLV08)
Chemical Name	2-Octanamidoacetic acid
EC Number	238-122-3
IUPAC Name	2-(octanoylamino)acetic acid
InChI	InChI=1S/C10H19NO3/c1-2-3-4-5-6-7-9(12)11-8-10(13)14/h2-8H2,1H3,(H,11,12)(H,13,14)
InChI Key	SAVLIIGUQOSOEP-UHFFFAOYSA-N
MDL Number	MFCD00154701
Molecular Formula	C10H19NO3
Molecular Weight	201.2628
SMILES	O=C(O)CNC(CCCCCCC)=O
UNII	8TY5YO42NJ
Synonyms	2-octanamidoacetic acid, Caprylylglycine, 14246-53-8, capryloylglycine, Capryloyl glycine, N-(1-Oxooctyl)glycine, N-Octanoylglycine, Glycine, N-(1-oxooctyl)-, 2-(octanoylamino)acetic acid, UNII-8TY5YO42NJ, 8TY5YO42NJ, N-Capryloylglycine, N-octanoyl-Glycine, Lipacide C 8G, EINECS 238-122-3, AC1Q2VVE, N-(1-oxooctyl)-Glycine, EC 238-122-3, Glycine,N-(1-oxooctyl)-, AC1Q5OL5, SCHEMBL125481, DTXSID9065736, CHEBI:74099, CTK4C3117, SAVLIIGUQOSOEP-UHFFFAOYSA-N, AC1L3764, ZINC3075376, 9356AF, AKOS009254081, MCULE-7832794516, NE61157, AM806699, DB-021980, FT-0765017, ST24040954, ST50976868, N-Octanoylglycine, analytical reference material, 246C538, Z1443708521, N- (1- oxooctyl)glycine, C10H19NO3, CID84290, AR-1I1675, C10-H19-N-O3, 14413-01-5,

Complexity	180
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	201.136g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	201.266g/mol
Monoisotopic Mass	201.136g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	66.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

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