β-Methylcinnamylalkohol

2-Methyl-3-phenyl-2-propen-1-ol

HCID 560879

Grundinformationen

CAS
1504-55-8
Standard-SMILES
CC(=Cc1ccccc1)CO
InChIKey
LLNAMUJRIZIXHF-UHFFFAOYSA-N
Summenformel
C10H12O
Durchschnittliche Molmasse
148,2 g/mol
Monoisotopische Masse
148,088815

Namen und Bezeichner

Bevorzugter Name
2-Methyl-3-phenyl-2-propen-1-ol
IUPAC
2-methyl-3-phenylprop-2-en-1-ol
Lokaler Name
β-Methylcinnamylalkohol
Englischer Name
2-Methyl-3-phenyl-2-propen-1-ol
Summenformel
C10H12O
Molmasse
148.2

Namen und Synonyme

1504-55-82-Methyl-3-phenyl-2-propen-1-ol2-Propen-1-ol, 2-methyl-3-phenyl-DTXSID1061738RefChem:478649DTXCID30348762-methyl-3-phenyl-2-propenol2-methyl-3-phenyl-prop-2-en-1-olalpha-methyl cinnamyl alcoholSCHEMBL295402orb3028078SCHEMBL3470164
Weitere Namen anzeigen
2-Methyl-3-phenylprop-2-en-1-ol(E)-2-Methyl-3-phenylprop-2-en-1-olMETHYLSTYRYLCARBINOL2-methyl-3-phenyl-2-methylcinnamicalcohol2-Benzylidene-1-propanolα-Methylcinnamyl alcohola-Methylcinnamyl Alcohol(2E)-3-Phenyl-2-buten-1-olalpha-methyl-cinnamylalcoho
LLNAMUJRIZIXHF-UHFFFAOYSA-N3-Phenyl-2-methyl-2-propen-1-olAKOS026730688F9800896681-14-7

Datenbank-Bezeichner

CAS
1504-55-8
PubChem CID
560879
DTXSID
DTXSID1061738
EC Number
216-128-7

Eigenschaften

Berechnete Struktureigenschaften

XLogP
2,3
Polarare Oberfläche (TPSA)
20,2 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
1
Frei drehbare Bindungen
2
Schwere Atome
11

Physikochemische Eigenschaften

Schmelzpunkt
24 · 24-25 °C(Solv: ligroine (8032-32-4))
Siedepunkt
77 °C0.1 · 77 °C0.1 mm Hg(lit.)
Dichte
1.03 g/mL · 1.03 g/mL at 25 °C(lit.)
Brechungsindex
20 · n20/D 1.572(lit.)
Flammpunkt
230 °F · >230 °F
Löslichkeit
Almost insoluble in water, soluble in alcohol and oils.

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

This chemical does not meet GHS hazard criteria for 13.8% (22 of 159) of reports.

Warning

H315 (85.5%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (32.1%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (24.5%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 159 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 22 of 159 reports by companies.;There are 6 notifications provided by 137 of 159 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Regulatory Information · 2 Einträge

Chemical: 2-Propen-1-ol, 2-methyl-3-phenyl-

2-Propen-1-ol, 2-methyl-3-phenyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Other Safety InformationIMAP assessments - 2-Propen-1-ol, 2-methyl-3-phenyl-: Environment tier I assessment
Hazard Classes and CategoriesSkin Irrit. 2 (85.5%);Eye Irrit. 2 (32.1%);STOT SE 3 (24.5%)

Regulatorische Informationen

Regulatory Information · 2 Einträge

Chemical: 2-Propen-1-ol, 2-methyl-3-phenyl-

2-Propen-1-ol, 2-methyl-3-phenyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Sicherheitsdaten

wgk
2
tsca
TSCA listed
hs_code
2906290090
RTECS-Nr.
GE2340000
risk_code
36/37/38
Toxizität
The acute oral LD50 in rats was reported as 2.4 ml/kg (1.9-3.0 ml/kg) (Levenstein, 1974). The acute dermal LD50 in rabbits exceeded 5 g/kg (Levenstein, 1974).

Chemie und Industrie

Verwendung und Herstellung

Use ClassificationFragrance Ingredients
General Manufacturing Information2-Propen-1-ol, 2-methyl-3-phenyl-: ACTIVE

Anwendungen

OccurrenceHas apparently not been reported to occur in nature

Verwendentrans-2-Methyl-3-phenyl-2-propen-1-ol was used in the preparation of 5-methyl-4-phenyl-5-hexen-2-one.

Darstellung

synthetischeBy selective hydrogenation of methylcinnamic aldehyde

Anbieter52 Anbieter

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
上海莉凯化工技术有限公司16628776521 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Syntechem Co.,Ltd[email protected]

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