1.0 2010-04-08 22:14:58 UTC 2020-09-17 15:34:55 UTC FDB020353 Butyl formate Butyl formate, also known as butyl methanoate belongs to the class of organic compounds known as carboxylic acid esters. These are carboxylic acid derivatives in which the carbon atom from the carboxyl group is attached to an alkyl or an aryl moiety through an oxygen atom (forming an ester group). A formate ester resulting from the formal condensation of formic acid with the hydroxy group of butan-1-ol. Butyl formate is a brandy, fruity, and plum tasting compound. Butyl formate has been detected, but not quantified, in blackcurrants and pineapples. Butyl formate Butyl methanoate Butylester kyseliny mravenci FEMA 2916 Formic acid butyl ester Formic acid, butyl ester HCOO(CH2)3CH3 N-butyl formate n-Butyl formate [UN1128] [Flammable liquid] N-butyl methanoate C5H10O2 102.1317 102.068079564 butyl formate N-butylformate 592-84-7 CCCCOC=O InChI=1S/C5H10O2/c1-2-3-4-7-5-6/h5H,2-4H2,1H3 NMJJFJNHVMGPGM-UHFFFAOYSA-N belongs to the class of organic compounds known as carboxylic acid esters. These are carboxylic acid derivatives in which the carbon atom from the carbonyl group is attached to an alkyl or an aryl moiety through an oxygen atom (forming an ester group). Carboxylic acid esters Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Carboxylic acid derivatives Aliphatic acyclic compounds Carbonyl compounds Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Aliphatic acyclic compound Carbonyl group Carboxylic acid ester Hydrocarbon derivative Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound logp 1.53 ALOGPS logs -0.70 ALOGPS solubility 2.04e+01 g/l ALOGPS melting_point Mp -91.5° logp 1.2 ChemAxon pka_strongest_basic -6.8 ChemAxon iupac butyl formate ChemAxon average_mass 102.1317 ChemAxon mono_mass 102.068079564 ChemAxon smiles CCCCOC=O ChemAxon formula C5H10O2 ChemAxon inchi InChI=1S/C5H10O2/c1-2-3-4-7-5-6/h5H,2-4H2,1H3 ChemAxon inchikey NMJJFJNHVMGPGM-UHFFFAOYSA-N ChemAxon polar_surface_area 26.3 ChemAxon refractivity 26.8 ChemAxon polarizability 11.33 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsIr 9003 Specdb::MsIr 9004 Specdb::CMs 10224 Specdb::CMs 27190 Specdb::CMs 28332 Specdb::CMs 102156 Specdb::CMs 102157 Specdb::CMs 163514 Specdb::EiMs 1736 Specdb::MsMs 85578 Specdb::MsMs 85579 Specdb::MsMs 85580 Specdb::MsMs 147699 Specdb::MsMs 147700 Specdb::MsMs 147701 Specdb::MsMs 2821143 Specdb::MsMs 2821144 Specdb::MsMs 2821145 Specdb::MsMs 2857068 Specdb::MsMs 2857069 Specdb::MsMs 2857070 Specdb::NmrOneD 4194 Specdb::NmrOneD 42022 Specdb::NmrOneD 42023 Specdb::NmrOneD 42024 Specdb::NmrOneD 42025 Specdb::NmrOneD 42026 Specdb::NmrOneD 42027 Specdb::NmrOneD 42028 Specdb::NmrOneD 42029 Specdb::NmrOneD 42030 Specdb::NmrOneD 42031 Specdb::NmrOneD 42032 Specdb::NmrOneD 42033 Specdb::NmrOneD 42034 Specdb::NmrOneD 42035 Specdb::NmrOneD 42036 Specdb::NmrOneD 42037 Specdb::NmrOneD 42038 Specdb::NmrOneD 42039 Specdb::NmrOneD 42040 Specdb::NmrOneD 42041 HMDB40575 #<Reference:0x000055ce317949d8> Blackcurrant Type 1 specific Ribes nigrum 78511 Pineapple Type 1 specific Ananas comosus 4615 brandy fruity plum rum