AG002BI6

1984-06-1 | Octanoic acid, sodium salt (1:1)

AG002BI6

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CAS Number	1984-06-1
Catalog Number	AG002BI6(AGN-PC-0QPT1B)
Chemical Name	Octanoic acid, sodium salt (1:1)
EC Number	217-850-5
IUPAC Name	sodium;octanoate
InChI	InChI=1S/C8H16O2.Na/c1-2-3-4-5-6-7-8(9)10;/h2-7H2,1H3,(H,9,10);/q;+1/p-1
InChI Key	BYKRNSHANADUFY-UHFFFAOYSA-M
MDL Number	MFCD00058511
Molecular Formula	C8H15NaO2
Molecular Weight	166.1933
SMILES	CCCCCCCC([O-])=O.[Na+]
UNII	9XTM81VK2B
Synonyms	caprylic acid, caprylic acid, 14C-labeled, caprylic acid, aluminum salt, caprylic acid, ammonia salt, caprylic acid, barium salt, caprylic acid, cadmium salt, caprylic acid, calcium salt, caprylic acid, cesium salt, caprylic acid, chromium(+2) salt, caprylic acid, cobalt salt, caprylic acid, copper salt, caprylic acid, copper(+2) salt, caprylic acid, iridum(+3) salt, caprylic acid, iron(+3) salt, caprylic acid, lanthanum(+3) salt, caprylic acid, lead(+2) salt, caprylic acid, lithium salt, caprylic acid, manganese salt, caprylic acid, nickel(+2) salt, caprylic acid, potassium salt, caprylic acid, ruthenium(+3) salt, caprylic acid, sodium salt, caprylic acid, sodium salt, 11C-labeled, caprylic acid, tin salt, caprylic acid, tin(+2) salt, caprylic acid, zinc salt, caprylic acid, zirconium salt, caprylic acid, zirconium(+4) salt, lithium octanoate, octanoate, octanoic acid, sodium caprylate, sodium octanoate, SODIUM OCTANOATE, Sodium caprylate, 1984-06-1, Sodium n-octanoate, Octanoic acid, sodium salt, Sodium octoate, Natrium octanoat, Caprylic acid sodium salt, Octanoic acid sodium salt, Octanoic acid, sodium salt (1:1), MFCD00058511, UNII-9XTM81VK2B, 9XTM81VK2B, n-Octanoic Acid Sodium Salt, HSDB 5862, EINECS 217-850-5, Sodium caprylate (NF), Sodium caprylate [NF], AI3-50473, Sodium caprylate, 98%, caprylic acid, sodium salt, NoO notEa AAENI, PubChem12870, Sodium octanoate, 96%, Sodium caprylate [USAN], ACMC-1BO0W, SCHEMBL56211, KSC490S9T, Sodium Salt of Caprylic Acid, CHEMBL557076, Sodium caprylate: Octanoic acid, DTXSID3027451, CTK3J0999, KS-00000YJH, BYKRNSHANADUFY-UHFFFAOYSA-M, CHEBI:132100, ANW-13619, AKOS015901906, MCULE-8227046407, RTR-009215, TRA-0206488, AN-19785, AS-17478, LS-98001, SC-79959, TR-009215, FT-0701289, O0034, ST51037190, V0353, D08999, W-109735, I14-14709, UNII-6H91L1NXTW component BYKRNSHANADUFY-UHFFFAOYSA-M, Natriumoktanoat, caprylic acid, Potassium octanoate, Oktansaure Natriumsalz, C8H15NaO2, C8H15O2.Na, Sodium octanoate, 96% 100g, CID16123, CB10967, Sodium caprylate, 98% - 100G 100g, Caprylic Acid Sodium Salt 99% extra pure 250gm, 201612-61-5,

Complexity	94.1
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	166.097g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	166.196g/mol
Monoisotopic Mass	166.097g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	40.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

Lot Number