| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 11 | Yes |
Popular Name: Methyl 4-hydroxybenzoate Methyl 4-hydroxybenzoate
Find On: PubMed — Wikipedia — Google
CAS Numbers: 103669-43-8 , 17449-76-2 , 19438-10-9 , 26112-07-2 , 5026-62-0 , 99-76-3 , [5026-62-0] , [99-76-3]
2,5-Cyclohexadiene-1-carboxylic acid, 4-oxo-, methyl ester (9CI)
4-Hydroxybenzoic acid methyl ester
4-Hydroxybenzoic acid methyl ester sodium salt
4-Hydroxybenzoic acid methyl ester, 98%+
4-hydroxybenzoic acid methyl ester; Methyl 4-hydroxybenzoate; bmse010009
5026-62-0; D02458; Methylparaben sodium (NF)
benzoic acid, 4-hydroxy-, methyl ester
Methyl 4-hydroxybenzoate potassium
Methyl 4-Hydroxybenzoate [for Biochemical Research]
Methyl 4-hydroxybenzoate, sodium salt
Methyl 4-hydroxybenzoate, sodium salt, 99%
Methyl 4-hydroxycyclohexanecarboxylate
Methyl p-hydroxybenzoate sodium
Methyl Parahydroxybenzoate (JAN); Methylparaben (NF
p-Hydroxybenzoic acid methyl ester
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 1.63 | 2.31 | -6.78 | 1 | 3 | 0 | 47 | 152.149 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 125 - 128 | Acros Organics |
| Melting_Point | 125-128? | Alfa-Aesar |
| Melting_Point | 125-128° | Alfa-Aesar |
| MP | 126 - 128 | Enamine Building Blocks |
| MP | 126...128 | Enamine Building Blocks |
| MP | 127 | TCI |
| BP | 280 | TCI |
| BP [°C] | 298.6 | Acros Organics |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Mp [°C] | >125 | Acros Organics |
| Boiling_Point | ca 280? dec. | Alfa-Aesar |
| Boiling_Point | ca 280° dec. | Alfa-Aesar |
| H phrase | H315: Causes skin irritation; H318: Causes serious eye damage; H412: Harmful to aquatic life with long lasting effects | Acros Organics |
| H phrase | H319: Causes serious eye irritation | Acros Organics |
| H phrase | H412: Harmful to aquatic life with long lasting effects | Acros Organics |
| P phrase | P273: Avoid release to the environment | Acros Organics |
| P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection | Acros Organics |
| P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P273: Avoid release to th | Acros Organics |
| R phrase | R36: Irritating to eyes. | Acros Organics |
| R phrase | R38: Irritating to skin.; R41: Risk of serious damage to eyes. | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S39: Wear eye/face protection. | Acros Organics |
| UniProt Database Links | SIGE_MYCTU | ChEBI |
| Hazard | XI: Irritant | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.