1.0 2010-04-08 22:08:24 UTC 2019-11-26 03:03:25 UTC FDB009075 Caprolactam Caprolactam, also known as aminocaproic lactam or hexahydro-2h-azepin-2-one, is a member of the class of compounds known as caprolactams. Caprolactams are cyclic amides of caproic acid. Caproic acid is the carboxylic acid derived from hexane with the general formula C5H11COOH. Caprolactam is soluble (in water) and a very weakly acidic compound (based on its pKa). Caprolactam is an amine, bitter, and spicy tasting compound found in sunflower, which makes caprolactam a potential biomarker for the consumption of this food product. Caprolactam (CPL) is an organic compound with the formula (CH2)5C(O)NH. This colourless solid is a lactam (a cyclic amide) of caproic acid. Global demand for this compound is approximately 5 million tons per year, and the vast majority is used to make Nylon 6 filament, fiber, and plastics . 1-Aza-2-cycloheptanone 1,6-Hexalactam 1,6-Hexolactam 2-Azacycloheptanone 2-Azepanone 2-Ketohexamethyleneimine 2-Ketohexamethylenimine 2-Oxohexamethyleneimine 2-Oxohexamethylenimine 2-Perhydroazepinone 2H-Azepin-2-one, hexahydro- 2H-Azepin-7-one, hexahydro- 6-amino-hexanoic acid lactam 6-Aminocaproic acid lactam 6-Aminohexanoic acid cyclic lactam 6-Aminohexanoic acid lactam 6-Caprolactam 6-Hexanelactam Akulon Alkamid Amilan cm 1001 Aminocaproic lactam Aza-2-cycloheptanone azepan-2-one Bonamid Capran 77C Caprolactam Caprolactam monomer Caprolattame Caprolon v Capron Chemlon cis-Hexahydro-2-azepinone Cyclohexanone iso-oxime Danamid Durethan BK E-caprolactam E-caprolactum Epsilon-caprolactam Ertalon 6sa Extrom 6N Gamma-caprolactam Grilon Hexahydro-2-azepinone Hexahydro-2H-azepin-2-one Hexannic acid hexanoic acid-6-amino-lactam Hexanolactam Hexanone isoxime Itamid Kaprolit Kaprolon Kapromine Kapron Maranyl F 114 Metamid Miramid H 2 Nipro (I) Nylon A1035sf Omega-caprolactum Orgamid rmnocd Orgamide Perhydroazepin-2-one Plaskin 8200 Plaskon 201 Polyamide pk 4 Relon p Renyl MV Sipas 60 Spencer 401 Spencer 601 Steelon Stilon Stylon Tarlon x-a Tarlon XB Tarnamid T 2 Tarnamid T 27 TNK 2G5 Torayca N 6 U-caprolactam Ultramid BMK Vidlon Widlon Zytel 211 C6H11NO 113.1576 113.084063979 azepan-2-one caprolactam 105-60-2 O=C1CCCCCN1 InChI=1S/C6H11NO/c8-6-4-2-1-3-5-7-6/h1-5H2,(H,7,8) JBKVHLHDHHXQEQ-UHFFFAOYSA-N belongs to the class of organic compounds known as caprolactams. These are cyclic amides of caproic acid. Caproic acid is the carboxylic acid derived from hexane with the general formula C5H11COOH. Caprolactams Organic compounds Organoheterocyclic compounds Lactams Caprolactams Aliphatic heteromonocyclic compounds Azacyclic compounds Azepanes Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds Secondary carboxylic acid amides Aliphatic heteromonocyclic compound Azacycle Azepane Caprolactam Carbonyl group Carboxamide group Carboxylic acid derivative Hydrocarbon derivative Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Secondary carboxylic acid amide a lactam caprolactams logp -0.08 ALOGPS logs 0.14 ALOGPS solubility 1.56e+02 g/l ALOGPS melting_point 69.3 oC logp 0.31 ChemAxon pka_strongest_acidic 14.99 ChemAxon pka_strongest_basic -1.4 ChemAxon iupac azepan-2-one ChemAxon average_mass 113.1576 ChemAxon mono_mass 113.084063979 ChemAxon smiles O=C1CCCCCN1 ChemAxon formula C6H11NO ChemAxon inchi InChI=1S/C6H11NO/c8-6-4-2-1-3-5-7-6/h1-5H2,(H,7,8) ChemAxon inchikey JBKVHLHDHHXQEQ-UHFFFAOYSA-N ChemAxon polar_surface_area 29.1 ChemAxon refractivity 31.46 ChemAxon polarizability 12.47 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 1 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::EiMs 1434 Specdb::MsIr 10583 Specdb::MsIr 10584 Specdb::MsIr 10585 Specdb::CMs 27635 Specdb::CMs 32084 Specdb::CMs 34015 Specdb::CMs 102576 Specdb::CMs 102577 Specdb::CMs 131211 Specdb::CMs 138945 Specdb::NmrOneD 3473 Specdb::NmrOneD 3619 Specdb::NmrOneD 69552 Specdb::NmrOneD 69553 Specdb::NmrOneD 69554 Specdb::NmrOneD 69555 Specdb::NmrOneD 69556 Specdb::NmrOneD 69557 Specdb::NmrOneD 69558 Specdb::NmrOneD 69559 Specdb::NmrOneD 69560 Specdb::NmrOneD 69561 Specdb::NmrOneD 69562 Specdb::NmrOneD 69563 Specdb::NmrOneD 69564 Specdb::NmrOneD 69565 Specdb::NmrOneD 69566 Specdb::NmrOneD 69567 Specdb::NmrOneD 69568 Specdb::NmrOneD 69569 Specdb::NmrOneD 69570 Specdb::NmrOneD 69571 Specdb::MsMs 76617 Specdb::MsMs 76618 Specdb::MsMs 76619 Specdb::MsMs 136488 Specdb::MsMs 136489 Specdb::MsMs 136490 Specdb::MsMs 3050069 Specdb::MsMs 3050070 Specdb::MsMs 3050071 Specdb::MsMs 3119887 Specdb::MsMs 3119888 Specdb::MsMs 3119889 28579 Sunflower Type 1 specific Helianthus annuus 4232 amine bitter spicy allelochemic 41 herbicide 986 A substance used to destroy plant pests. pesticide 1210 Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests.