Hexyl 4-hydroxybenzoate

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Names

[ CAS No. ]:
1083-27-8

[ Name ]:
Hexyl 4-hydroxybenzoate

[Synonym ]:
Benzoic acid, 4-hydroxy-, hexyl ester (9CI)
Hexylparaben
MFCD00016480
4-Hydroxybenzoic Acid Hexyl Ester
Hexyl 4-hydroxybenzoate
Benzoic acid, 4-hydroxy-, hexyl ester

Chemical & Physical Properties

[ Density]:
1.1±0.1 g/cm3

[ Boiling Point ]:
339.0±15.0 °C at 760 mmHg

[ Melting Point ]:
53°C

[ Molecular Formula ]:
C13H18O3

[ Molecular Weight ]:
222.280

[ Flash Point ]:
138.5±13.2 °C

[ Exact Mass ]:
222.125595

[ PSA ]:
46.53000

[ LogP ]:
4.52

[ Vapour Pressure ]:
0.0±0.8 mmHg at 25°C

[ Index of Refraction ]:
1.518

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DH2204000
CHEMICAL NAME :
Benzoic acid, p-hydroxy-, hexyl ester
CAS REGISTRY NUMBER :
1083-27-8
BEILSTEIN REFERENCE NO. :
2723592
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H18-O3
MOLECULAR WEIGHT :
222.31
WISWESSER LINE NOTATION :
QR DVO6

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
3400 mg/kg
TOXIC EFFECTS :
Peripheral Nerve and Sensation - local anesthetic Behavioral - analgesia
REFERENCE :
AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 128,135,1960

Safety Information

[ Hazard Codes ]:
Xn

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S36/37/39

[ RTECS ]:
DH2204000

[ HS Code ]:
2918290000

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 1-Hexanol
  • 4-Hydroxybenzoic acid
  • 1-Bromohexane

DownStream

Customs

[ HS Code ]: 2918290000

[ Summary ]:
HS: 2918290000 other carboxylic acids with phenol function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) VAT:17.0% MFN tariff:6.5% General tariff:30.0%

Related Compounds

  • Hexyl 4-hydroxybenzoate-d4
  • hexyl 4-[3-(diethylamino)propanoylamino]-2-hydroxybenzoate,hydrochloride
  • hexyl 4-[[2-(diethylamino)acetyl]amino]-2-hydroxybenzoate,hydrochloride
  • hexyl 4-acetamidobenzenesulfonate
  • hexyl 4-(dimethylamino)-2-phenylpyrimidine-5-carboxylate
  • hexyl-[4-[[4-[hexyl(dimethyl)azaniumyl]phenyl]methyl]phenyl]-dimethylazanium,dichloride
  • 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 4-(pentyloxy)benzoate
  • (2,3-dihydro-1H-inden-4-yl)methyl 4-methylbenzene-1-sulfonate
  • 5-(3-Amino-1,1-difluoropropyl)thiophene-2-carbonitrile
  • tert-butyl N-(4-carbamoyl-2-hydroxyphenyl)carbamate
  • 2,3-Dihydro-1,4-benzodioxin-6-yl 4-methylbenzene-1-sulfonate
  • 3-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-methylpentanamido]cyclobutane-1-carboxylic acid
  • 2-[4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)butanamido]spiro[3.3]heptane-2-carboxylic acid
  • 1-[(2S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propanoyl]-4,4-difluoropyrrolidine-3-carboxylic acid
  • 2-[(Cyclopent-1-en-1-yl)methyl]oxolane-2-carbaldehyde
  • rac-2-{[(1R,2S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)cyclopentyl]formamido}-2-(methoxymethyl)butanoic acid
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