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106-25-2

106-25-2 structural image
Product Name: NEROL
Formula: C10H18O
Synonyms: cis-3,7-Dimethyl-2,6-octadien-1-ol;Nerol
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Liquid
Color/Form Colorless oily liquid
Odor Sweet rose
Taste Bitter flavor
Boiling Point 225 °C
Melting Point <-15 °C
Flash Point Flash Point: 107.78 °C /226 °F (closed cup)
Solubility In water, 1311 mg/L at 25 °C
Density 9.8756 g/cu cm at 20 °C
Vapor Pressure 0.03 [mmHg]
LogP log Kow = 3.47
Stability/Shelf Life Chemical stability: Stable under recommended storage conditions.
Refractive Index Index of refraction: 1.4746 at 20 °C/D
Kovats Retention Index 1215 1209 1232 1233.3 1208 1253 1208 1237 1209 1230 1209 1209 1213 1212 1214 1232 1208 1209 1212 1211 1211 1205 1211 1211 1214 1210 1210 1207 1204 1211 1212 1207 1207 1207 1213 1209 1207 1207 1207 1230 1219 1212 1213 1227 1219 1234 1211 1212 1208 1210 1209 1213 1212 1218 1239 1232 1220 1211 1206 1220 1230 1214 1214 1218 1215 1213 1211.6 1210 1218 1208 1209 1219 1222 1218 1220 1221 1224 1229 1233 1232 1213 1210 1208 1213 1209 1207 1248 1214 1206 1206 1234 1215 1207 1212 1220 1240 1217 1239 1211 1208 1214 1232 1213 1211 1219 1221 1206 1217 1219 1219 1214 1218 1219 1213 1218 1207 1223 1247 1247 1212 1220 1214 1219 1214 1208 1213 1206 1206 1207 1229 1260 1211 1219 1213 1218 1209 1228 1213 1206 1215.3 1214 1225 1210 1206 1210 1210 1230 1216 1240 1224 1208 1212 1211 1212 1209 1210 1212 1211 1208 1218
Chemical Classes Biological Agents -> Plant Oils and Extracts

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
H317:Sensitisation, Skin
H319:Serious eye damage/eye irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P272:Contaminated work clothing should not be allowed out of the workplace.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
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 154.25 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 4
Exact Mass 154.135765193 g/mol
Monoisotopic Mass 154.135765193 g/mol
Topological Polar Surface Area 20.2 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 150
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Nerol is the (2Z)-stereoisomer of 3,7-dimethylocta-2,6-dien-1-ol. It has been isolated from the essential oils from plants like lemon grass. It has a role as a volatile oil component, a plant metabolite and a fragrance.

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