1.0 2010-04-08 22:11:32 UTC 2019-11-26 03:10:54 UTC FDB014904 Viburtinal Production from the hydrolysis of esters present in Viburnum opulus (cranberry bush). Viburtinal is found in fruits. 4-Methyl-cyclopenta(c)pyran-7-carboxaldehyde 4-Methyl-cyclopenta[c]pyran-7-carboxaldehyde 4-Methylcyclopenta[c]pyran-7-carbaldehyde 4-Methylcyclopenta[c]pyran-7-carboxaldehyde, 9CI Cyclopenta(c)pyran-7-carboxaldehyde, 4-methyl- Cyclopenta[c]pyran-7-carboxaldehyde, 4-methyl- C10H8O2 160.1693 160.0524295 4-methylcyclopenta[c]pyran-7-carbaldehyde 4-methylcyclopenta[c]pyran-7-carbaldehyde 63661-79-0 CC1=COC=C2C(C=O)=CC=C12 InChI=1S/C10H8O2/c1-7-5-12-6-10-8(4-11)2-3-9(7)10/h2-6H,1H3 IHEBZQKYPSMVBZ-UHFFFAOYSA-N belongs to the class of organic compounds known as aryl-aldehydes. Aryl-aldehydes are compounds containing an aldehyde group directly attached to an aromatic ring. Aryl-aldehydes Organic compounds Organic oxygen compounds Organooxygen compounds Carbonyl compounds Aromatic heteropolycyclic compounds Heteroaromatic compounds Hydrocarbon derivatives Organic oxides Oxacyclic compounds Aromatic heteropolycyclic compound Aryl-aldehyde Heteroaromatic compound Hydrocarbon derivative Organic oxide Organoheterocyclic compound Oxacycle logp 2.03 ALOGPS logs -1.81 ALOGPS solubility 2.46e+00 g/l ALOGPS melting_point Mp 90-92° logp 2.33 ChemAxon pka_strongest_basic -3 ChemAxon iupac 4-methylcyclopenta[c]pyran-7-carbaldehyde ChemAxon average_mass 160.1693 ChemAxon mono_mass 160.0524295 ChemAxon smiles CC1=COC=C2C(C=O)=CC=C12 ChemAxon formula C10H8O2 ChemAxon inchi InChI=1S/C10H8O2/c1-7-5-12-6-10-8(4-11)2-3-9(7)10/h2-6H,1H3 ChemAxon inchikey IHEBZQKYPSMVBZ-UHFFFAOYSA-N ChemAxon polar_surface_area 30.21 ChemAxon refractivity 46.65 ChemAxon polarizability 16.52 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 20583 Specdb::CMs 133860 Specdb::CMs 141594 Specdb::MsIr 7079 Specdb::MsIr 7080 Specdb::MsMs 80607 Specdb::MsMs 80608 Specdb::MsMs 80609 Specdb::MsMs 141519 Specdb::MsMs 141520 Specdb::MsMs 141521 Specdb::MsMs 2456529 Specdb::MsMs 2456530 Specdb::MsMs 2456531 Specdb::MsMs 2479525 Specdb::MsMs 2479526 Specdb::MsMs 2479527 Specdb::NmrOneD 133478 Specdb::NmrOneD 133479 Specdb::NmrOneD 133480 Specdb::NmrOneD 133481 Specdb::NmrOneD 133482 Specdb::NmrOneD 133483 Specdb::NmrOneD 133484 Specdb::NmrOneD 133485 Specdb::NmrOneD 133486 Specdb::NmrOneD 133487 Specdb::NmrOneD 133488 Specdb::NmrOneD 133489 Specdb::NmrOneD 133490 Specdb::NmrOneD 133491 Specdb::NmrOneD 133492 Specdb::NmrOneD 133493 Specdb::NmrOneD 133494 Specdb::NmrOneD 133495 Specdb::NmrOneD 133496 Specdb::NmrOneD 133497 HMDB36073 #<Reference:0x000055ce336399b0> Fruits Unknown generic