propyl acetate

{{chembox

| Verifiedfields = changed

| Watchedfields = changed

| verifiedrevid = 464216999

| Name = Propyl acetate

| ImageFile_Ref = {{chemboximage|correct|??}}

| ImageFile1 = Propyl-acetate-2D-skeletal.svg

| ImageAlt1 = Skeletal formula of propyl acetate

| ImageSize1 = 150px

| ImageFile2 = Propyl acetate 3D ball.png

| ImageSize2 = 150px

| ImageAlt2 = Ball-and-stick model of the propyl acetate molecule

| PIN = Propyl acetate

| SystematicName = Propyl ethanoate

| OtherNames = Acetic acid propyl ester
n-Propyl ethanoate
n-Propyl acetate
n-Propyl ester of acetic acid

|Section1={{Chembox Identifiers

| CASNo_Ref = {{cascite|correct|CAS}}

| CASNo = 109-60-4

| ChEBI_Ref = {{ebicite|correct|EBI}}

| ChEBI = 40116

| ChEMBL_Ref = {{ebicite|correct|EBI}}

| ChEMBL = 44857

| ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}}

| ChemSpiderID = 7706

| DrugBank_Ref = {{drugbankcite|correct|drugbank}}

| DrugBank = DB01670

| EC_number = 203-686-1

| PubChem = 7997

| RTECS = AJ3675000

| UNNumber = 1276

| UNII_Ref = {{fdacite|correct|FDA}}

| UNII = 4AWM8C91G6

| SMILES = O=C(OCCC)C

| InChI = 1/C5H10O2/c1-3-4-7-5(2)6/h3-4H2,1-2H3

| InChIKey = YKYONYBAUNKHLG-UHFFFAOYAC

| StdInChI_Ref = {{stdinchicite|correct|chemspider}}

| StdInChI = 1S/C5H10O2/c1-3-4-7-5(2)6/h3-4H2,1-2H3

| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}}

| StdInChIKey = YKYONYBAUNKHLG-UHFFFAOYSA-N

}}

|Section2={{Chembox Properties

| C=5 | H=10 | O=2

| Appearance = Colorless liquid

| Odor = Mild, fruity

| Density = 0.89{{nbsp}}g/cm3{{GESTIS|ZVG=33670}}

| MeltingPtC = −95

| MeltingPt_ref =

| BoilingPtC = 102

| BoilingPt_ref =

| Solubility = 18.9{{nbsp}}g/L

| VaporPressure = 25{{nbsp}}mmHg (20{{nbsp}}°C)

| MagSus = −65.91·10−6 cm3/mol

}}

|Section7={{Chembox Hazards

| ExternalSDS =

| NFPA-H = 2

| NFPA-F = 3

| NFPA-R = 2

| GHSPictograms = {{GHS02}}{{GHS07}}

| GHSSignalWord = Danger

| HPhrases = {{H-phrases|225|319|336}}

| PPhrases = {{P-phrases|210|233|240|241|242|243|261|264|271|280|303+361+353|304+340|305+351+338|312|337+313|370+378|403+233|403+235|405|501}}

| FlashPtC = 10

| FlashPt_ref =

| AutoignitionPtC = 450

| LD50 = 9370{{nbsp}}mg/kg (oral, rat)
8300{{nbsp}}mg/kg (oral, mouse)
6640{{nbsp}}mg/kg (oral, rabbit)
8700{{nbsp}}mg/kg (oral, rat){{IDLH|109604|n-Propyl acetate}}
17800{{nbsp}}mg/kg (dermal, rabbit)Union Carbide Data Sheet. Vol. 1/25/1965

| IDLH = 1700 ppm{{PGCH|0532}}

| REL = TWA 200{{nbsp}}ppm (840{{nbsp}}mg/m3) ST 250{{nbsp}}ppm (1050{{nbsp}}mg/m3)

| PEL = TWA 200{{nbsp}}ppm (840{{nbsp}}mg/m3)

| ExploLimits = 1.7–8%

| LCLo = 8941{{nbsp}}ppm (cat, 5{{nbsp}}hr){{IDLH|109604|n-Propyl acetate}}

}}

|Section8={{Chembox Related

| OtherFunction_label = esters

| OtherFunction = Ethyl acetate
Isopropyl acetate
n-butyl acetate
Isobutyl acetate

| OtherCompounds = Propan-1-ol
Acetic acid

}}

}}

Propyl acetate, also known as propyl ethanoate, is an organic compound. Nearly 20,000 tons are produced annually for use as a solvent. This colorless liquid is known by its characteristic odor of pears. Due to this fact, it is commonly used in fragrances and as a flavor additive. It is formed by the esterification of acetic acid and propan-1-ol, often via Fischer–Speier esterification, with sulfuric acid as a catalyst and water produced as a byproduct.{{Citation |last=Papa |first=Anthony J. |title=Propanols |date=2011-10-15 |url=https://doi.org/10.1002/14356007.a22_173.pub2 |work=Ullmann's Encyclopedia of Industrial Chemistry |place=Weinheim, Germany |publisher=Wiley-VCH Verlag GmbH & Co. KGaA |doi=10.1002/14356007.a22_173.pub2 |access-date=2022-03-29}}

References

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