2.0 2012-05-31 14:24:40 -0600 2015-06-03 17:19:12 -0600 ECMDB20047 M2MDB000896 2-Naphthaldehyde 2-naphthaldehyde is a member of the chemical class known as Naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings. 2-Formylnaphthalene 2-Naphthalenecarboxaldehyde 2-Naphthalenecarboxaldehyde (9CI) b-Formylnaphthalene b-Naphthaldehyde b-Naphthylaldehyde b-Naphthylcarboxaldehyde Beta-Formylnaphthalene Beta-Naphthaldehyde Beta-Naphthylaldehyde Beta-Naphthylcarboxaldehyde N206_ALDRICH NAPHTHALENE-2-CARBONITRILE β-Formylnaphthalene β-Naphthaldehyde β-Naphthylaldehyde β-Naphthylcarboxaldehyde C11H8O 156.1806 156.057514878 naphthalene-2-carbaldehyde 2-naphthaldehyde 66-99-9 O=CC1=CC2=CC=CC=C2C=C1 InChI=1S/C11H8O/c12-8-9-5-6-10-3-1-2-4-11(10)7-9/h1-8H PJKVFARRVXDXAD-UHFFFAOYSA-N Solid Inner membrane Membrane Outer membrane logp 3.00 ALOGPS logs -3.30 ALOGPS solubility 7.85e-02 g/l ALOGPS melting_point 62 oC logp 2.68 ChemAxon pka_strongest_basic -7.1 ChemAxon iupac naphthalene-2-carbaldehyde ChemAxon average_mass 156.1806 ChemAxon mono_mass 156.057514878 ChemAxon smiles O=CC1=CC2=CC=CC=C2C=C1 ChemAxon formula C11H8O ChemAxon inchi InChI=1S/C11H8O/c12-8-9-5-6-10-3-1-2-4-11(10)7-9/h1-8H ChemAxon inchikey PJKVFARRVXDXAD-UHFFFAOYSA-N ChemAxon polar_surface_area 17.07 ChemAxon refractivity 49.09 ChemAxon polarizability 16.83 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Microbial metabolism in diverse environments ec01120 Naphthalene degradation ec00626 Collection of Reactions without pathways PW001891 Metabolic Specdb::CMs 36837 Specdb::CMs 173265 Specdb::NmrOneD 252808 Specdb::NmrOneD 252809 Specdb::NmrOneD 252810 Specdb::NmrOneD 252811 Specdb::NmrOneD 252812 Specdb::NmrOneD 252813 Specdb::NmrOneD 252814 Specdb::NmrOneD 252815 Specdb::NmrOneD 252816 Specdb::NmrOneD 252817 Specdb::NmrOneD 252818 Specdb::NmrOneD 252819 Specdb::NmrOneD 252820 Specdb::NmrOneD 252821 Specdb::NmrOneD 252822 Specdb::NmrOneD 252823 Specdb::NmrOneD 252824 Specdb::NmrOneD 252825 Specdb::NmrOneD 252826 Specdb::NmrOneD 252827 Specdb::MsMs 26771 Specdb::MsMs 26772 Specdb::MsMs 26773 Specdb::MsMs 33329 Specdb::MsMs 33330 Specdb::MsMs 33331 Specdb::MsMs 3225094 Specdb::MsMs 3225095 Specdb::MsMs 3225096 Specdb::MsMs 3225097 Specdb::MsMs 3225098 Specdb::MsMs 3225099 6201 5966 C14099 Kanehisa, M., Goto, S., Sato, Y., Furumichi, M., Tanabe, M. (2012). "KEGG for integration and interpretation of large-scale molecular data sets." Nucleic Acids Res 40:D109-D114. 22080510 Aldehyde-alcohol dehydrogenase P0A9Q7 ADHE_ECOLI adhE http://ecmdb.ca/proteins/P0A9Q7.xml S-(hydroxymethyl)glutathione dehydrogenase P25437 FRMA_ECOLI frmA http://ecmdb.ca/proteins/P25437.xml Alcohol dehydrogenase, propanol-preferring P39451 ADHP_ECOLI adhP http://ecmdb.ca/proteins/P39451.xml predicted Fe-containing alcohol dehydrogenase, Pfam00465 family P37686 yiaY http://ecmdb.ca/proteins/P37686.xml (2-Naphthyl)methanol + NAD <> 2-Naphthaldehyde + NADH + Hydrogen ion R06927 (2-Naphthyl)methanol + NAD > 2-Naphthaldehyde + Hydrogen ion + NADH PW_R005893