Compound: 6674-22-2
SMILES: N1=C2N(CCCCC2)CCC1
InChIKey: GQHTUMJGOHRCHB-UHFFFAOYSA-N
Synonyms: 6674-22-2, 1,8-Diazabicyclo[5.4.0]undec-7-ene, 1,8-Diazabicyclo(5.4.0)undec-7-ene, Pyrimido[1,2-a]azepine, 2,3,4,6,7,8,9,10-octahydro-, H1ILJ6IBUX, DTXSID2049424, AMICURE DBUE, DABCO DBU, NSC-111184, DTXCID1029384, ALCANPOUDRE DBU 70-3KG, NSC-230466, 1,8-DIAZA-7-BICYCLO(5.4.0)UNDECENE, Pyrimido(1,2-a)azepine, 2,3,4,6,7,8,9,10-octahydro-, 1,8-diazabicyclo(5.4.0]undec-7-ene, 1,8-Diazabicyclo[5.4.0}undec-7-ene, 1,8-diazabicyclo{5.4.0]undec-7-ene, RefChem:73734, 1,8-DBU, 229-713-7, 2,3,4,6,7,8,9,10-Octahydropyrimido[1,2-a]azepine, DBU, 1,8-diazabicyclo[5,4,0]undec-7-ene, 1,8-Diazabicyclo[5.4.0]-7-undecene, 2H,3H,4H,6H,7H,8H,9H,10H-pyrimido[1,2-a]azepine, MFCD00006930, 1,8-diazabicyclo(5,4,0)undec-7-ene, 1,8-diazabicyclo[5,4,0]-undec-7-ene, CHEMBL1489129, 1,8-diazabicyclo[5.4.0]undec-7-en, 1,5-Diazabicyclo[5.4.0]-5-undecene, 1,5-Diazabicyclo[5.4.0]undec-5-ene, 2,3,4,6,7,8,9,10-Octahydropyrimidol[1,2-a]azepine, 1,5-Diazabicyclo(5.4.0)undec-5-ene, 1,8-diazabicyclo[5.4.0]undeca-7-ene, 1,8-diazabicyclo (5.4.0)undec-7-ene, 1,8-diazabicyclo [5.4.0]-7-undecene, UNII-H1ILJ6IBUX, 1,8-diazabicyclo(5.4.0)undec-7ene, 1,8-diazabicyclo[5.4.0]undec-7ene, 1,8-diazabicyclo(5.4.0)undec-7-en, 1,8-diazabicyclo[5.4.0)-7-undecene, 1,8-diazabicyclo(5.4.0)undeca-7-ene, 1,8-diazabicyclo [5.4.0]undec-7-ene, 1,8-diazabicyclo(5,4,0)-undec-7-ene, 1,8-diazabicyclo (5,4,0) undec-7-ene, 1,8-diazabicyclo (5.4.0) undec-7-ene, 1,8-diazabicyclo [5,4,0] undec-7-ene, 1,8-diazabicyclo [5.4.0] undec-7-ene, 1,8-diazabicyclo-[5,4,0]-undec-7-ene, 1,8-Diazabicyclo-(5,4,0)-undec-7-ene, 2,3,4,6,7,8,9,10-octahydropyrimido(1,2-a)azepine, 1,8-diazabicyclo[5,4,0]undec-7-en, MLS000039793, CCRIS 9417, 2,3,4,5-tetrahydro-6H,7H,8H,9H,10H-pyrimidino[1,2-a]azaperhydroepine, EINECS 229-713-7, Tipiracil Impurity 7, NSC 111184, NSC 230466, 1,8-Diazabicyclo[5.4,0]undec-7-ene, EC 229-713-7, SCHEMBL3047, orb1908964, SCHEMBL17417853, SCHEMBL19066792, 2,3,4,6,7,8,9,10-Octahydropyrimido(1,2-alpha)azepine, HMS2456O11, STR00657, 1,5-Diaza(5,4,0)undec-5-ene, 1,5-diaza(5.4.0)undec-5-ene, Tox21_202939, BDBM50000167, EBC-04306, NSC111184, SBB055512, STK802306, 1,8-Diazabicyclo[540]undec-7-ene, 1,8-diazabicyclo(5.4.0)undecene-7, 1,8-diazabicyclo[5.4.0]undec7-ene, 1,8-diazabicylo[5.4.0]undec-7-en, 1,8diazabicyclo[5.4.0]undec-7-ene, AKOS009031277, 1,8-diazabicylo[5.4.0]undec-7-ene, AC-2471, FD46281, PS-4098, 1,5-diazabicyclo[5,4,0]-5-undecene, 1,8 diazabicyclo[5.4.0]undec-7-ene, 1,8-diaza-bicyclo[5.4.0]undec-7ene, 1,8-diazabicyclo-[5.4.0]undec-7ene, 1,8-diazabicyclo[5,4,0]-7-undecene, 1,8-diazabicyclo[5,4,01-7-undecene, 1,8-diazabicyclo[5.4,0]-7-undecene, 1,8-diazabicyclo[5.4.0]-undec-7ene, 1,8-diazabicyclo[5.4.0]undec 7-ene, 1,8-diazabicyclo[5.4.0]undeca-7-en, 1,8-diazabicylco[5,4,0]undec-7-ene, 1,8-diazabicylco[5.4.0]undec-7-ene, 1.8-diazabicyclo[5,4,0]-7-undecene, 1.8-diazabicyclo[5,4,0]undec-7-ene, 1.8-diazabicyclo[5.4.0]-7-undecene, 1.8-diazabicyclo[5.4.0]undec-7-ene, 1,8-diazabicyclo[5,4,0]undeca-7-ene, 1,8-diazabicylo[5.4.0] undec-7-ene, l,8-diazabicyclo[5.4.0] undec-7-ene, NCGC00260485-01, 1, 8-Diazabicyclo[5.4.0]undec-7-ene, 1,8 -diazabicyclo[5,4,0]undec-7-ene, 1,8 diazabicyclo [5.4.0] undec-7ene, 1,8 Diazabicyclo[5,4,0]-undec-7-ene, 1,8- diazabicyclo[5.4.0]undec-7-ene, 1,8-diaza bicyclo[5,4,0]undec-7-ene, 1,8-diaza-bicyclo[5.4.0]undec-7-ene, 1,8-diazabicyclo [5,4,0]-7-undecene, 1,8-diazabicyclo [5,4,0]undec-7-ene, 1,8-Diazabicyclo-[5,4,0]undec-7-ene, 1,8-diazabicyclo-[5.4.0]undec-7-ene, 1,8-diazabicyclo[5, 4.0]undec-7-ene, 1,8-Diazabicyclo[5,4,0] undec-7-ene, 1,8-diazabicyclo[5.4.0] undec-7-ene, 1,8-diazabicyclo[5.4.0]-undec-7-ene, 1,8-diazabicyclo[5.4.0]-undeca-7-ene, 1,8-diazabicyclo[5.4.0]undecan-7-ene, 1.8-diazabicyclo [5.4.0]undec-7-ene, 1.8-diazabicyclo[5.4.0]-undec-7-ene, BP-25116, BP-30004, SMR000036948, 1,8-diaza-bicyclo[5.4.0]-undec-7-ene, 1,8-diazabicyclo [5.4.0]-undec-7-ene, 1,8-diazabicyclo-[ 5.4.0]undec-7-ene, 1,8-diazabicyclo-[5.4.0]-undec-7-ene, 1,8-diazabicyclo[5.4.0]- undec-7-ene, 1.8-diazabicyclo (5.4.0) undec-7-ene, CAS-6674-22-2, 1, 8-Diazabicyclo [5.4.0]undec-7-ene, DB-291150, 1,8-diazabicyclo- [5.4.0]-undec-7-ene, CS-0009461, D1270, NS00004166, ST50308548, 1,8-Diazabicyclo[5.4.0]undec-7-ene(DBU), EN300-21428, 1,8-Diazabicyclo[5.4.0]undec-7-ene, 98%, D72474, F033415, Pyrimido[1, 2,3,4,6,7,8,9,10-octahydro-, Q306166, 1,8-DIAZABICYCLO(5.4.0)UNDEC-7-ENE [MI], 2,3,4,6,7,8,9,10-octahydro-pyrimido[1,2-a]azepin, 2,3,4,6,7,8,9,10-Octahydro-pyrimido[1,2-a]azepine, 2,3,4,6,7,8,9,10-octahydropyrimido-[1,2-a]azepine, F0001-1771, Z104496570, 2,3,4,6,7,8,9,10-octahydro -pyrimido[1,2-a]azepin, 2,4,6,7,8,9,10-Octahydropyrimido[1,2-.alpha.]azepine, 1,8-Diazabicyclo[5.4.0]undec-7-ene, purum, >=98.0% (GC), 2,3,4,6,7,8,9,10-Octahydropyrimido(1,2-.alpha.)azepine, 1,8-Diazabicyclo[5.4.0]undec-7-ene, puriss., >=99.0% (GC)
Theoretical properties:
molecular_formula: C9H16N2
molecular_weight: 152.24 g/mol
exact_mass: 152.131348519 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 0
hydrogen_bond_acceptor_count: 1
rotatable_bond_count: 0
heavy_atom_count: 11
topological_polar_surface_area: 15.6 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
vapor_pressure: 0.05 [mmHg]
Descriptions:
chembl: Unnamed Compound is a small molecule listed in the ChEMBL database but has not progressed to an approved clinical phase.
wikipedia: 1,8-Diazabicyclo[5.4.0]undec-7-ene, or more commonly DBU, is a chemical compound and belongs to the class of amidine compounds. It is used in organic synthesis as a catalyst, a complexing ligand, and a non-nucleophilic base.