4-Methylbenzyl acetate

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Names

[ CAS No. ]:
2216-45-7

[ Name ]:
4-Methylbenzyl acetate

[Synonym ]:
4-Methylbenzyl ethanoate
MFCD00017234
p-Xylyl acetate
p-methylbenzyl actate
p-Tolubenzyl acetate
Benzenemethanol, 4-methyl-, acetate
p-Acetoxymethyltoluene
4-Methylbenzyl acetate
4-tolyl acetate
p-Xylene, α-acetoxy
p-Methylbenzyl alcohol acetate
p-Methylbenzyl acetate
EINECS 218-689-3

Chemical & Physical Properties

[ Density]:
1.0±0.1 g/cm3

[ Boiling Point ]:
224.5±9.0 °C at 760 mmHg

[ Molecular Formula ]:
C10H12O2

[ Molecular Weight ]:
164.201

[ Flash Point ]:
98.0±17.1 °C

[ Exact Mass ]:
164.083725

[ PSA ]:
26.30000

[ LogP ]:
2.39

[ Vapour Pressure ]:
0.1±0.4 mmHg at 25°C

[ Index of Refraction ]:
1.505

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DA4940000
CHEMICAL NAME :
Benzenemethanol, 4-methyl-, acetate
CAS REGISTRY NUMBER :
2216-45-7
BEILSTEIN REFERENCE NO. :
2046163
LAST UPDATED :
199701
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C10-H12-O2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 30,79S,1992
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 30,79S,1992

Safety Information

[ Hazard Codes ]:
Xn

[ Risk Phrases ]:
R36/37/38

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

[ RTECS ]:
DA4940000

[ HS Code ]:
2915390090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • p-tolylmethanol
  • Ethanoic anhydride
  • acetic acid
  • p-Xylene
  • ethyl acetate
  • Acetyl chloride
  • vinyl acetate
  • p-Tolualdehyde
  • Methyl acetate
  • Isopropenyl acetate

DownStream

  • p-tolylmethanol
  • 4-(Hydroxymethyl)benzoic acid
  • Ac-HMBA-linker
  • 4-Formylbenzoic acid
  • acetic acid,[4-(hydroxymethyl)phenyl]methanol
  • Acetic acid 4-formylbenzyl ester
  • p-Tolualdehyde
  • 4-Methylbenzoic acid

Customs

[ HS Code ]: 2915390090

[ Summary ]:
2915390090. esters of acetic acid. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). MFN tariff:5.5%. General tariff:30.0%

Related Compounds

  • 4-Methylbenzyl acetate
  • 4-Methylbenzyl acetate
  • α-cyano-4-methylbenzyl acetate
  • 5-acetamido-2-iodo-4-methylbenzyl acetate
  • 4-methylbenzyl 2-((3S,4R)-4-(4-amino-5-chloro-2-methoxybenzamido)-3-methoxypiperidin-1-yl)acetate
  • 4-(N,N-dimethylamino)-3-methylbenzyl acetate
  • methyl 4-(1-methyl-1H-indol-3-yl)-2,4-dioxobutanoate
  • 3-Amino-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxamide hydrochloride
  • [4-[2-(Diethylamino)ethylcarbamoyl]phenyl]boronic acid
  • Phenyl quinolin-5-ylcarbamate
  • (S)-Fmoc-2-amino-3-decyloxy-propionic acid
  • Trifluoroacetic Acid-13C
  • 2,3,4,5-Tetrahydro-1,6-benzodioxocine-8-carbaldehyde
  • 4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-2-nitrobenzonitrile
  • {4-[(Pyridin-4-yl)methyl]morpholin-2-yl}methanamine
  • (5S,8R,9S,10S,13S,14S,16R)-16-Hydroxy-10,13-dimethyltetradecahydrospiro[cyclopenta[A]phenanthrene-3,2'-[1,3]dioxolan]-17(2H)-one
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