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89-81-6

89-81-6 structural image
Product Name: PIPERITONE
Formula: C10H16O
Synonyms: p-Menth-1-en-3-one;3-Carvomenthenone;6-Isopropyl-3-methyl-2-cyclohexen-1-one
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Boiling Point 233.00 to 235.00 °C. @ 760.00 mm Hg
Melting Point < 25 °C
Solubility very slightly
Density 0.929-0.934
LogP 2.85
Refractive Index 1.483-1.487
Kovats Retention Index 1234 1246 1246 1228 1243 1232 1250 1228 1219 1226 1226 1223 1234 1223 1218 1218 1231 1233 1233 1232 1232 1235 1221 1232 1235 1236 1236 1228 1223 1255 1222 1233 1233 1237 1230 1233 1256 1231 1232 1242 1233.3 1236 1250 1221 1238 1231 1231 1229 1224 1224 1235 1237 1226 1229 1236 1229 1226 1236 1232 1236 1237 1236 1234 1233 1227 1249 1235 1221 1221 1248 1228.2 1237.4 1222 1222 1280 1224 1232 1228 1235 1236 1235 1241.2 1233 1230 1223 1235 1248 1237 1243 1245 1247 1235 1236 1223 1233 1247 1235 1225 1230 1230 1231

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
Precautionary Statement Codes P302+P352:IF ON SKIN: wash with plenty of soap and water.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 152.23 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 1
Exact Mass 152.120115130 g/mol
Monoisotopic Mass 152.120115130 g/mol
Topological Polar Surface Area 17.1 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 189
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Piperitone is a p-menthane monoterpenoid that is cyclohex-2-en-1-one substituted by a methyl group at position 3 and an isopropyl group at position 6. It has a role as a volatile oil component and a plant metabolite. It is a p-menthane monoterpenoid and a cyclic terpene ketone.