Compound: 4-hydroxybenzaldehyde
SMILES: O=Cc1ccc(O)cc1
InChIKey: RGHHSNMVTDWUBI-UHFFFAOYSA-N
Synonyms: 4-hydroxybenzaldehyde, p-Hydroxybenzaldehyde, 123-08-0, 4-Formylphenol, p-Formylphenol, Benzaldehyde, 4-hydroxy-, p-Oxybenzaldehyde, Parahydroxybenzaldehyde, Para-Hydroxybenzaldehyde, NSC-2127, O1738X3Y38, DTXSID8059552, FEMA NO. 3984, CHEBI:17597, RefChem:99272, DTXCID7033787, 204-599-1, 4-Hydroxy benzaldehyde, 4-HYDROXY-BENZALDEHYDE, Benzaldehyde, p-hydroxy-, USAF M-6, MFCD00006939, Bisoprolol EP Impurity S, NSC 2127, 4-hydoxybenzaldehyde, p-hydroxy benzaldehyde, p-Hydroxy-benzaldehyde, 4-Hydroxybenzenecarbonal, CHEMBL14193, BR1235, 4-formyl phenol, EINECS 204-599-1, BRN 0471352, AI3-15366, CCRIS 8911, PARA-HYDROXY BENZALDEHYDE, 4-formyl-phenol, UNII-O1738X3Y38, p-OH-benzaldehyde, 4hydroxybenzaldehyde, p-hydroxibezaldehyde, p-hydroxybenzaldehye, 4-Hydroxybenzaldehyde; Bisoprolol Fumarate Imp. S (EP); Bisoprolol Imp. S (EP); Bisoprolol Fumarate Impurity S; Bisoprolol Impurity S, 4-hydroxybenzaldehyd, 4-hydroxybezaldehyde, 4-Hydroxybenzaldehye, 4-hydroxibenzaldehyde, 4-hydroxylbenzaldehyde, 4--hydroxybenzaldehyde, p-hydroxyl benzaldehyde, 4-hydroxyl benzaldehyde, 4-hydroxy- benzaldehyde, PYRILAMINE_met038, WLN: VHR DQ, bmse000259, bmse000582, bmse010005, SCHEMBL37193, 4-Hydroxybenzaldehyde, 98%, 4-08-00-00251 (Beilstein Handbook Reference), BIDD:ER0339, SCHEMBL546705, orb1304658, SCHEMBL2645835, SCHEMBL5841067, 4-Hydroxybenzaldehyde, >=97%, p-Hydroxybenzaldehyde (Standard), SCHEMBL10789402, GTPL13597, HY-Y0313R, NSC2127, 1k03, P-HYDROXYBENZALDEHYDE [MI], CS-D1179, HY-Y0313, STR00705, 4-HYDROXYBENZALDEHYDE [FHFI], 4-Hydroxybenzaldehyde, >=97%, FG, BDBM50177411, EBC-44273, s6008, SBB028743, STK188428, AKOS000119184, AC-2984, DB03560, FH02556, MSK001114-100A, PS-3635, NCGC00188243-01, NCGC00188243-02, 4-Hydroxybenzaldehyde, analytical standard, BP-30158, SY003489, 4-Hydroxybenzaldehyde, >=95.0% (HPLC), DB-003763, H0198, NS00014566, ST45167178, EN300-18030, C00633, AB-131/40191192, BISOPROLOL FUMARATE IMPURITY S [EP IMPURITY], Q1953888, 4-Hydroxybenzaldehyde, Vetec(TM) reagent grade, 95%, Z57127520, F2190-0635, p-Hydroxybenzaldehyde Solution in Acetonitrile, 100ug/mL, InChI=1/C7H6O2/c8-5-6-1-3-7(9)4-2-6/h1-5,9
Theoretical properties:
molecular_formula: C7H6O2
molecular_weight: 122.12 g/mol
exact_mass: 122.036779430 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 1
hydrogen_bond_acceptor_count: 2
rotatable_bond_count: 1
heavy_atom_count: 9
topological_polar_surface_area: 37.3 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
Descriptions:
pubchem: 4-hydroxybenzaldehyde is a hydroxybenzaldehyde that is benzaldehyde substituted with a hydroxy group at position C-4. It has a role as an EC 1.14.17.1 (dopamine beta-monooxygenase) inhibitor, a mouse metabolite and a plant metabolite.
chebi: A  hydroxybenzaldehyde that is benzaldehyde substituted with a hydroxy group at position C-4.
chembl: 4-HYDROXYBENZALDEHYDE is a small molecule listed in the ChEMBL database but has not progressed to an approved clinical phase.
wikipedia: 4‑Hydroxy­benzaldehyde (para‑hydroxy­benzaldehyde) is an organic compound with the formula C6H4OH(CHO). Along with 2-hydroxybenzaldehyde and 3-hydroxybenzaldehyde, it is one of the three isomers of hydroxybenzaldehyde.