Hexyl benzoate

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Names

[ CAS No. ]:
6789-88-4

[ Name ]:
Hexyl benzoate

[Synonym ]:
MFCD00051714
EINECS 229-856-5
Hexyl benzoate
Benzoic acid, hexyl ester

Chemical & Physical Properties

[ Density]:
1.0±0.1 g/cm3

[ Boiling Point ]:
286.7±8.0 °C at 760 mmHg

[ Molecular Formula ]:
C13H18O2

[ Molecular Weight ]:
206.281

[ Flash Point ]:
120.7±6.0 °C

[ Exact Mass ]:
206.130676

[ PSA ]:
26.30000

[ LogP ]:
4.85

[ Vapour Pressure ]:
0.0±0.6 mmHg at 25°C

[ Index of Refraction ]:
1.495

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DH1490000
CHEMICAL NAME :
Benzoic acid, hexyl ester
CAS REGISTRY NUMBER :
6789-88-4
BEILSTEIN REFERENCE NO. :
2048117
LAST UPDATED :
199806
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C13-H18-O2
MOLECULAR WEIGHT :
206.31
WISWESSER LINE NOTATION :
6OVR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 17,813,1979 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
12300 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AMIHBC AMA Archives of Industrial Hygiene and Occupational Medicine. (Chicago, IL) V.2-10, 1950-54. For publisher information, see AEHLAU. Volume(issue)/page/year: 4,119,1951
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
21 mL/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AMIHBC AMA Archives of Industrial Hygiene and Occupational Medicine. (Chicago, IL) V.2-10, 1950-54. For publisher information, see AEHLAU. Volume(issue)/page/year: 4,119,1951

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H315

[ Personal Protective Equipment ]:
Eyeshields;Gloves

[ Risk Phrases ]:
R38

[ Safety Phrases ]:
S36

[ RIDADR ]:
3265.0

[ WGK Germany ]:
2

[ RTECS ]:
DH1490000

[ Hazard Class ]:
8.0

[ HS Code ]:
2916310090

Precursor & DownStream

Precursor

  • hexoxymethylbenzene
  • benzoic acid
  • 1-Hexanol
  • Benzoyl chloride
  • 1-(2,5-Dichlorophenyl)-2,2-bis(methylsulfanyl)vinyl benzoate
  • Benzyl alcohol
  • Sodium Benzoate
  • 1-Bromohexane
  • Benzaldehyde
  • Benzoic anhydride

DownStream

  • Benzyl alcohol
  • benzoic acid

Customs

[ HS Code ]: 2916310090

[ Summary ]:
2916310090 other benzoic acid and its salts and esters。supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward)。VAT:17.0%。tax rebate rate:9.0%。MFN tariff:6.5%。general tariff:30.0%

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Related Compounds

  • 4-n-butoxy pheny hexyl benzoate
  • 6-(2-methylpiperidin-1-yl)hexyl benzoate
  • 6-(tert-butoxycarbonylamino)hexyl benzoate
  • Diethylamino hydroxybenzoyl hexyl benzoate
  • 6-([1,1'-biphenyl]-4-ylmethoxy)hexyl benzoate
  • 2-[(4-methylphenyl)sulfonylamino]hexyl benzoate