Compound: Tetradecanoic acid
SMILES: O=C(O)CCCCCCCCCCCCC
InChIKey: TUNFSRHWOTWDNC-UHFFFAOYSA-N
Synonyms: Tetradecanoic acid, MYRISTIC ACID, 544-63-8, n-Tetradecanoic acid, n-Tetradecan-1-oic acid, Crodacid, 1-Tridecanecarboxylic acid, n-Tetradecoic acid, Hydrofol acid 1495, Univol U 316S, Emery 655, Hystrene 9014, Myristinsaeure, Myristic acid, pure, tetradecoic acid, FEMA No. 2764, C14:0, NSC-5028, PHILACID-1400, PRIFRAC-2942, 0I3V7S25AW, DTXSID6021666, CHEBI:28875, DTXCID501666, Acid, Myristic, Acid, Tetradecanoic, fatty acid 14:0, RefChem:6045, 208-875-2, Myristic acid (natural), CCRIS 4724, HSDB 5686, NSC 5028, acide tetradecanoique, Philacid 1400, CH3-[CH2]12-COOH, AI3-15381, Prifac 2942, MFCD00002744, CHEMBL111077, MYRISTIC-14-13C ACID, NSC5028, Lead dimyristate, FA 14:0, MyristicAcid-13C14, 32112-52-0, CAS-544-63-8, Myristic acid [NF], 62217-70-3, EINECS 208-875-2, BRN 0508624, myristoate, UNII-0I3V7S25AW, miristic acid, myristoic acid, n-Tetradecanoate, Tetradecanoicacid, 3usx, Myristic acid pure, Hystrene 9514, Edenor C 14, 1-Tridecanecarboxylate, Myristic acid, 95%, Myristic acid, natural, tridecanecarboxylic acid, Myristic acid (8CI), Myristic Acid, Reagent, 3v2n, 3w9k, Myristic acid, puriss., Myristic acid, ?99%, Myristic acid (Standard), Myristic acid [WHO-DD], Tetradecanoic acid (9CI), bmse000737, Epitope ID:176772, 1-tetradecanecarboxylic acid, MYRISTIC ACID [II], MYRISTIC ACID [MI], SCHEMBL6374, MYRISTIC ACID [FCC], MYRISTIC ACID [FHFI], MYRISTIC ACID [HSDB], 4-02-00-01126 (Beilstein Handbook Reference), MLS002152942, WLN: QV13, SCHEMBL159834, SCHEMBL248269, SCHEMBL297756, SCHEMBL303698, Tetradecanoic (Myristic) acid, MYRISTIC ACID [MART.], GTPL2806, orb1303528, orb3025303, SCHEMBL6797636, MYRISTIC ACID [USP-RS], SCHEMBL10610970, SCHEMBL27684919, HY-N2041R, MSK1712, IS_D27-TETRADECANOIC ACID, HMS3039E15, HMS3648O20, HMS5086C04, Myristic acid, analytical standard, HY-N2041, EINECS 250-924-5, Myristic acid, >=98.0% (GC), Tox21_201852, Tox21_302781, BDBM50147581, EBC-46129, LMFA01010014, s5617, SBB060024, STL185697, Myristic acid, >=95%, FCC, FG, Myristic acid, Sigma Grade, >=99%, AKOS009156714, CCG-266785, DB08231, DS-3833, FM62595, NSC 122834, NCGC00091068-01, NCGC00091068-02, NCGC00091068-03, NCGC00256547-01, NCGC00259401-01, AC-34674, BP-27915, SMR001224536, ST023797, Tetradecanoic acid-1-13C (Myristic acid), CS-0018531, M0476, NS00010444, EN300-78099, C06424, G74510, Myristic acid, Vetec(TM) reagent grade, 98%, F241293, Q422658, SR-01000854525, SR-01000854525-3, F8889-5016, Z1954802504, EDAE4876-C383-4AD4-A419-10C0550931DB, MYRISTIC ACID (CONSTITUENT OF SAW PALMETTO) [DSC], Myristic acid, United States Pharmacopeia (USP) Reference Standard, Myristic acid, Pharmaceutical Secondary Standard; Certified Reference Material
Theoretical properties:
molecular_formula: C14H28O2
molecular_weight: 228.37 g/mol
exact_mass: 228.208930132 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 1
hydrogen_bond_acceptor_count: 2
rotatable_bond_count: 12
heavy_atom_count: 16
topological_polar_surface_area: 37.3 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
physical_state: Oily, white, crystalline solid
color: Oily, white, crystalline solid
odor: The odor should be faint with no rancidity.
boiling_point: 482.9 °F at 100 mmHg (NTP, 1992)
melting_point: 129 °F (NTP, 1992)
density: 0.8622 at 129 °F (NTP, 1992) - Less dense than water; will float
solubility: less than 1 mg/mL at 64 °F (NTP, 1992)
flash_point: greater than 235 °F (NTP, 1992)
vapor_pressure: 1 mmHg at 288 °F ; 5 mmHg at 345 °F; 760 mmHg at 604 °F (NTP, 1992)
Descriptions:
pubchem: Tetradecanoic acid is a straight-chain, fourteen-carbon, long-chain saturated fatty acid mostly found in milk fat. It has a role as a human metabolite, an EC 3.1.1.1 (carboxylesterase) inhibitor, a Daphnia magna metabolite and an algal metabolite. It is a long-chain fatty acid and a straight-chain saturated fatty acid. It is a conjugate acid of a tetradecanoate.
chebi: A straight-chain, fourteen-carbon, long-chain saturated fatty acid mostly found in milk fat.
chembl: MYRISTIC ACID is a small molecule listed in the ChEMBL database and has reached clinical trial phase -1.0.
wikipedia: Myristic acid (IUPAC name: tetradecanoic acid) is a common saturated fatty acid with the molecular formula CH3(CH2)12COOH. Its salts and esters are commonly referred to as myristates or tetradecanoates. The name of the acyl group derived from myristic acid is myristoyl or tetradecanoyl. The acid is named after the binomial name for nutmeg (Myristica fragrans), from which it was first isolated in 1841 by Lyon Playfair.