| Identification | More | [Name]
4-HYDROXY-3-METHYLBENZOIC ACID | [CAS]
499-76-3 | [Synonyms]
4-HYDROXY-3-METHYLBENZOIC ACID
AKOS BBS-00004298
RARECHEM AL BE 0693
4,3-Cresoticacid
4-Hydroxy-m-toluicacid
4-HYDROXY-3-METHYLBENZOIC ACID hemihydrate | [EINECS(EC#)]
207-890-1 | [Molecular Formula]
C8H8O3 | [MDL Number]
MFCD00270105 | [Molecular Weight]
152.15 | [MOL File]
499-76-3.mol |
| Chemical Properties | Back Directory | [Melting point ]
173-177 °C | [Boiling point ]
112 °C(Press: 1 Torr) | [density ]
1.304±0.06 g/cm3(Predicted) | [storage temp. ]
Inert atmosphere,Room Temperature | [solubility ]
soluble in Methanol | [form ]
powder to crystal | [pka]
4?+-.0.10(Predicted) | [color ]
Light yellow to Yellow to Orange | [InChI]
1S/C8H8O3/c1-5-4-6(8(10)11)2-3-7(5)9/h2-4,9H,1H3,(H,10,11) | [InChIKey]
LTFHNKUKQYVHDX-UHFFFAOYSA-N | [SMILES]
Cc1cc(ccc1O)C(O)=O | [CAS DataBase Reference]
499-76-3(CAS DataBase Reference) |
| Safety Data | Back Directory | [Hazard Codes ]
Xn,Xi | [Risk Statements ]
R22:Harmful if swallowed.
R37/38:Irritating to respiratory system and skin .
R41:Risk of serious damage to eyes. | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/39:Wear suitable protective clothing and eye/face protection . | [WGK Germany ]
2
| [HazardClass ]
IRRITANT | [HS Code ]
29182900 | [Storage Class]
11 - Combustible Solids | [Hazard Classifications]
Acute Tox. 4 Oral
Eye Dam. 1
Skin Irrit. 2
STOT SE 3 |
| Hazard Information | Back Directory | [Chemical Properties]
Orange-red powder or solid | [Uses]
4-Hydroxy-3-methylbenzoic acid is a normal organic acid identified in urine specimens from a healthy population. | [Definition]
ChEBI: A monohydroxybenzoic acid that is 4-hydroxybenzoic acid substituted by a methyl group at position 3. | [IC 50]
Human Endogenous Metabolite | [storage]
Store at -20°C | [References]
[1] Chapman PJ, et al. The bacterial metabolism of 2,4-xylenol. Biochem J. 1968 Dec;110(3):491-8. DOI:10.1042/bj1100491 |
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