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| CAS Number | 124-07-2 |
| Catalog Number | AG000LCW(AGN-PC-00BDZ3) |
| Chemical Name | Octanoic Acid |
| FEMA Number | 2799 |
| IUPAC Name | octanoic acid |
| InChI | InChI=1S/C8H16O2/c1-2-3-4-5-6-7-8(9)10/h2-7H2,1H3,(H,9,10) |
| InChI Key | WWZKQHOCKIZLMA-UHFFFAOYSA-N |
| MDL Number | MFCD00004509 |
| Molecular Formula | C8H16O2 |
| Molecular Weight | 144.2114 |
| NSC Number | 5024 |
| SMILES | CCCCCCCC(=O)O |
| UN Number | 3265 |
| UNII | OBL58JN025 |
| 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,
octanoic acid,
caprylic acid,
124-07-2,
n-octanoic acid,
n-caprylic acid,
Octylic acid,
octoic acid,
n-octylic acid,
n-Octoic acid,
neo-fat 8,
1-heptanecarboxylic acid,
Enantic acid,
Octic acid,
C-8 acid,
Caprylsaeure,
capryloate,
Kaprylsaeure,
Hexacid 898,
Acido octanoico,
0ctanoic acid,
Acide octanoique,
Acidum octanocium,
Caprylic acid (natural),
Fatty acids, C6-10,
Kyselina kaprylova,
octylate,
Octansaeure,
1-octanoic acid,
Acide octanoique [French],
Acido octanoico [Spanish],
Acidum octanocium [Latin],
Kyselina kaprylova [Czech],
NSC 5024,
Octanoic acid [USAN:INN],
UNII-OBL58JN025,
MFCD00004429,
OCTANOIC ACID (CAPRYLIC ACID),
FEMA No. 2799,
CCRIS 4689,
HSDB 821,
C8:0,
Emery 657,
Prifac 2901,
Lunac 8-95,
EINECS 204-677-5,
BRN 1747180,
CH3-[CH2]6-COOH,
AI3-04162,
caprylic acid, zinc salt,
OBL58JN025,
CHEBI:28837,
caprylic acid, barium salt,
caprylic acid, sodium salt,
NSC5024,
WWZKQHOCKIZLMA-UHFFFAOYSA-N,
caprylic acid, cadmium salt,
caprilate,
Caprylic acid, potassium salt,
n-caprylate,
caprylic acid, tin(+2) salt,
n-octoate,
n-octylate,
FA(8:0),
caprylic acid, copper(+2) salt,
Octanoic acid, 99%,
NCGC00090957-01,
C8H16O2,
1-heptanecarboxylate,
DSSTox_CID_1645,
DSSTox_RID_76259,
DSSTox_GSID_21645,
OCA,
CAS-124-07-2,
CH3-[CH2]6-COO(-),
caprylic acid, tin salt,
caprylic acid, cesium salt,
caprylic acid, cobalt salt,
caprylic acid, copper salt,
caprylic acid, ammonia salt,
caprylic acid, calcium salt,
caprylic acid, 14C-labeled,
octanoicacid,
caprylic acid, aluminum salt,
caprylic acid, manganese salt,
caprylic acid, zirconium salt,
octanic acid,
Caprilic acid,
caprylic acid, iron(+3) salt,
caprylic acid, lead(+2) salt,
acidum octanoicum,
octanoate radical,
caprylic acid, iridum(+3) salt,
caprylic acid, nickel(+2) salt,
caprylic acid, chromium(+2) salt,
caprylic acid, lanthanum(+3) salt,
caprylic acid, ruthenium(+3) salt,
caprylic acid, zirconium(+4) salt,
EINECS 273-085-7,
Acid C8,
Octanoic acid radical,
Caprylic acid (NF),
Kortacid 0899,
Neo-Fat 8S,
Caprylic Acid 657,
Octanoate, ion(1-),
caprylic acid, sodium salt, 11C-labeled,
n-heptanecarboxylic acid,
Octanoic acid (USAN),
Fatty acids, C6-1O,
ACMC-1BTHQ,
Lunac 8-98,
AC1Q2VVU,
18312-04-4,
C8:0 (Lipid numbers),
Heptane-1-carboxylic acid,
Octanoic acid, >=98%,
Octanoic acid, >=99%,
bmse000502,
Caprylic/Capric Acid Blend,
EC 204-677-5,
SCHEMBL3933,
WLN: QV7,
NCIOpen2_002902,
NCIOpen2_009358,
Octanoic acid (USAN/INN),
4-02-00-00982 (Beilstein Handbook Reference),
68937-74-6,
KSC174S6D,
MLS002415762,
Octanoic acid, >=96.0%,
Octanoic acid, zirconium salt,
Octanoic acid (mixed isomers),
AC1L193V,
CHEMBL324846,
GTPL4585,
Octanoic acid, >=98%, FG,
QSPL 011,
QSPL 184,
DTXSID3021645,
CTK0H4961,
KS-00000WZB,
HMS2270A23,
Octanoic acid, analytical standard,
NSC-5024,
ZINC1530416,
EINECS 242-197-8,
Tox21_111045,
Tox21_201279,
Tox21_300345,
ANW-18188,
LMFA01010008,
LS-691,
SBB060020,
STL282742,
AKOS000118802,
Octanoic acid, natural, >=98%, FG,
Octanoic acid, zirconium salt (1:?),
AN-1411,
DB04519,
MCULE-5193957469,
NE10316,
Octanoic acid, for synthesis, 99.5%,
RTR-003747,
NCGC00090957-02,
NCGC00090957-03,
NCGC00090957-04,
NCGC00254446-01,
NCGC00258831-01,
HY-41417,
M789,
SMR001252279,
TR-003747,
597-EP2269988A2,
597-EP2270008A1,
597-EP2275413A1,
597-EP2287156A1,
597-EP2292617A1,
597-EP2298780A1,
597-EP2301940A1,
597-EP2305689A1,
597-EP2311807A1,
597-EP2311824A1,
597-EP2374787A1,
AK00487762,
CS-0016549,
FT-0660765,
O0027,
ST51046283,
C06423,
D05220,
146488-EP2280007A1,
146488-EP2292597A1,
SR-01000865607,
I04-1204,
J-005040,
SR-01000865607-2,
BRD-K35170555-001-07-9,
Z955123584,
Octanoic acid, certified reference material, TraceCERT(R),
UNII-13FB83DEYU component WWZKQHOCKIZLMA-UHFFFAOYSA-N,
UNII-DI775RT244 component WWZKQHOCKIZLMA-UHFFFAOYSA-N,
43FDA9D7-2300-41E7-A373-A34F25B81553,
Caprylic acid, European Pharmacopoeia (EP) Reference Standard,
UNII-79P21R4317 component WWZKQHOCKIZLMA-UHFFFAOYSA-N,
Caprylic acid, United States Pharmacopeia (USP) Reference Standard,
Caprylic Acid (Octanoic Acid), Pharmaceutical Secondary Standard; Certified Reference Material,
octanoate,
Sodium caprylate,
Oktansaure,
Caprylate,
Lithium octanoate,
palmitic acid,
n-octansaure,
Acide octanoque,
n-octanoate,
oleic acid,
n-octic acid,
Zirconium octoate,
SODIUM OCTANOATE,
Zirconium octanoate,
MYRISTIC ACID,
Octanoic acid zinc salt,
OAA (CHRIS Code),
caprylic acid, lithium salt,
Carboxylic acids, C5-9,
Octanoic acid, ion(1-),
Fatty acids, C6-1-0,
D0XS4G,
CID379,
Octanoic acid; (Caprylic acid),
C8-H16-O2,
CAPRYLIC-ACID, NATURAL (C8),
NA3265,
UN3265,
(2r)-2,3-Dihydroxypropyl (9z)-Octadec-9-Enoate,
C031492,
(13-Oxo-9(Z),11(E),15(Z)-Octadecatrienoic Acid),
Caprylic Acid 99% for synthesis (Octanoic Acid) 250ml,
(2s)-3-(Hexadecanoyloxy)-2-[(9z)-Octadec-9-Enoyloxy]propyl 2-(Trimethylammonio)ethyl Phosphate,
149-57-5,
68603-84-9,
C8,
DKA,
KZH,
MYR,
OLA,
OLC,
PLM,
POV,
|
| Complexity | 89.3 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 144.115g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 144.214g/mol |
| Monoisotopic Mass | 144.115g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
| Symbol: | |
| Hazard Class | 8 |
| Hazard statements | H314-H318 |
| Packing Group | Ⅲ |
| Precautionary statements | P280-P305+P351+P338-P310 |
| UN Code | UN 3265 |
| Chemical Name: | Batch Number: | |
| Chemical Structure: | CAS Registry No: | |
| Product ID: | ||
| Manufacture Date: | ||
| Storage Temperature: | ||
| Formula: | ||
| Molecular Weight: | ||
| Quantity: |
| Test: | Result: |

