ChemicalBook--->CAS DataBase List--->94-18-8

94-18-8

94-18-8 Structure

94-18-8 Structure
IdentificationMore
[Name]

Benzyl 4-hydroxybenzoate
[CAS]

94-18-8
[Synonyms]

4-Hxdroxybenzoic acid benzyl ester
4-HYDROXYBENZOIC ACID BENZYL ESTER
BASEPTOL
BENZYL 4-HYDROXYBENZOATE
BENZYLPARABEN
BENZYL P-HYDROXYBENZOATE
4-hydroxy-benzoicaciphenylmethylester
Benzoic acid, 4-hydroxy-, phenylmethyl ester
Benzoic acid, p-hydroxy-, benzyl ester
Benzoicacid,4-hydroxy-,phenylmethylester
Benzyl Parasept
Benzyl Tegosept
Nipabenzyl
Parosept
p-Hydroxybenzoic acid benzyl ester
Solbrol Z
PARABEN,BENZYL
BENZYLPARA-HYDROXYBENZOATE
PARABEN,BUTYL
4-hydroxy-benzoic acid phenylmethyl ester
[EINECS(EC#)]

202-311-9
[Molecular Formula]

C14H12O3
[MDL Number]

MFCD00016471
[Molecular Weight]

228.24
[MOL File]

94-18-8.mol
Chemical PropertiesBack Directory
[Appearance]

white to light yellow fine powder
[Melting point ]

109-112 °C(lit.)
[Boiling point ]

170℃
[density ]

1.1799
[vapor pressure ]

0Pa at 25℃
[refractive index ]

1.5805
[Fp ]

167℃
[storage temp. ]

Refrigerator
[solubility ]

ethanol: soluble25mg/mL, clear, colorless
[form ]

Powder
[pka]

8.18±0.15(Predicted)
[color ]

White to Almost white
[Water Solubility ]

92mg/L(25 ºC)
[BRN ]

2115995
[Major Application]

environmental
[Cosmetics Ingredients Functions]

PRESERVATIVE
ANTIMICROBIAL
[Cosmetic Ingredient Review (CIR)]

Benzylparaben (94-18-8)
[InChI]

1S/C14H12O3/c15-13-8-6-12(7-9-13)14(16)17-10-11-4-2-1-3-5-11/h1-9,15H,10H2
[Contact allergens]

This substance is one of the parabens family. Parabens are esters formed by p-hydroxybenzoic acid and an alcohol. They are largely used as biocides in cosmetics and toiletries, medicaments, or food. They have synergistic power with other biocides. Parabens can induce allergic contact dermatitis, mainly in chronic dermatitis and wounded skin.
[InChIKey]

MOZDKDIOPSPTBH-UHFFFAOYSA-N
[SMILES]

Oc1ccc(cc1)C(=O)OCc2ccccc2
[LogP]

2.185 at 25℃
[CAS DataBase Reference]

94-18-8(CAS DataBase Reference)
[NIST Chemistry Reference]

Benzyl 4-hydroxybenzoate(94-18-8)
[EPA Substance Registry System]

94-18-8(EPA Substance)
Hazard InformationBack Directory
[Chemical Properties]

white to light yellow fine powder
[Uses]

An antimicrobial
[Definition]

ChEBI: Benzyl parahydroxybenzoate is a benzoate ester and a benzyl ester.
[General Description]

Benzyl 4-hydroxybenzoate (Paraben, Benzyl Paraben) is an ester of para-hydroxy benzoic acid. It has been added to various cosmetics and personal care products as a preservative. Its quantification in cosmetics has been reported by HPLC methods. Microwave assisted synthesis of benzyl 4-hydroxybenzoate by reaction between (4-hydroxybenzoic) acid and K2CO3 in presence of phase transfer catalyst has been reported. It is an endocrine disrupting chemical (EDC). It is a promising candidate for use in pharmaceutical and personal care products. Its visible-light assisted photosensitized degradation in homogeneous aqueous solution of 4,4′,4′′,4′′′-(porphine-5,10,15,20-tetrayl)tetrakis(benzenesulphonic acid) has been investigated.
[Flammability and Explosibility]

Notclassified
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S37/39:Wear suitable gloves and eye/face protection .
[RIDADR ]

3077
[WGK Germany ]

3
[RTECS ]

DH2691000
[TSCA ]

Yes
[REACH Registrations]

Inactive
[HazardClass ]

IRRITANT
[PackingGroup ]

III
[HS Code ]

29181990
[Storage Class]

13 - Non Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Benzyl paraben(94-18-8).msds
Spectrum DetailBack Directory
[Spectrum Detail]

Benzylparaben(94-18-8)MS
Benzylparaben(94-18-8)1HNMR
Benzylparaben(94-18-8)13CNMR
Benzylparaben(94-18-8)IR1
Benzylparaben(94-18-8)IR2
Benzylparaben(94-18-8)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Benzyl 4-hydroxybenzoate, 98%(94-18-8)
[Alfa Aesar]

Benzyl 4-hydroxybenzoate, 99%(94-18-8)
[Sigma Aldrich]

94-18-8(sigmaaldrich)
[TCI AMERICA]

Benzyl 4-Hydroxybenzoate,>98.0%(GC)(T)(94-18-8)
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