2,6,6-Trimethylbicyclo[3.1.1]heptan-3-ol

2-Pinanol

HCID 10128CAS 473-54-1
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Grundinformationen

Standard-SMILES
CC1(O)CCC2CC1C2(C)C
InChIKey
YYWZKGZIIKPPJZ-UHFFFAOYSA-N
Summenformel
C10H18O
Durchschnittliche Molmasse
154,25 g/mol
Monoisotopische Masse
154,13576519

Namen und Bezeichner

Bevorzugter Name
2-Pinanol
IUPAC
2,6,6-trimethylbicyclo[3.1.1]heptan-2-ol
Lokaler Name
2,6,6-Trimethylbicyclo[3.1.1]heptan-3-ol
Englischer Name
PINANOL 85
Summenformel
C10H18O
Molmasse
154.25

Namen und Synonyme

2-PINANOL473-54-1Pinanol2,6,6-Trimethylbicyclo[3.1.1]heptan-2-ol5DZK63N3UUDTXSID5029180Bicyclo(3.1.1)heptan-2-ol, 2,6,6-trimethyl-2,6,6-Trimethylbicyclo(3.1.1)heptane-3-ol2,6,6-TRIMETHYLBICYCLO(3.1.1)HEPTAN-2-OLRefChem:89121DTXCID509180207-466-6
Weitere Namen anzeigen
TRANS-2-PINANOLPinan-2-olDL-pinan-3-ol(2R)-Pinane-3α-olcis+trans-2-pinanol2,6,6-trimethylnorpinan-2-ol2,6,6-trimethyl-bicyclo[3.1.1]heptan-2-o
PINANOL 85(E)-Pinene hydrate(E)-2-pinanol(E)-Pinan-2-olHSDB 5663EINECS 207-466-6.beta.-Pinene hydroxideUNII-Q3IVK90KUD

Datenbank-Bezeichner

CAS
473-54-1、4948-29-2
PubChem CID
10128
DTXSID
DTXSID5029180
EC Number
207-466-6
Nikkaji
J40.558B

Eigenschaften

Berechnete Struktureigenschaften

XLogP
2,1
Polarare Oberfläche (TPSA)
20,2 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
1
Frei drehbare Bindungen
0
Schwere Atome
11

Experimentelle und physikochemische Eigenschaften

Vapor Pressure0.07 [mmHg]
Physical Description · 2 Einträge

CBI

Nearly white solid; mp = 22-24 deg C; Camphor-type odor; [MSDSonline]

Kovats Retention Index · 2 Einträge

1114；1118

1124；1145

Physikochemische Eigenschaften

Schmelzpunkt
55 · 55 - 60°C
storage temp.
Refrigerator, under inert atmosphere
Löslichkeit
Chloroform (Slightly), Diethyl Ether (Slightly), Methanol (Slightly)
Aggregatzustand
Solid
Farbe
White to Off-White
Kosmetik-Inhaltsstoffe Funktionen
PERFUMING

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H302 (60.7%): Harmful if swallowed [Warning Acute toxicity, oral]；H311 (39.3%): Toxic in contact with skin [Danger Acute toxicity, dermal]；H312 (60.7%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (73%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P262, P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P351+P338, P316, P317, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 89 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；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 · 3 Einträge

Chemical: Bicyclo[3.1.1]heptan-2-ol, 2,6,6-trimethyl-

Bicyclo[3.1.1]heptan-2-ol, 2,6,6-trimethyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Bicyclo[3.1.1]heptan-2-ol, 2,6,6-trimethyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Bicyclo3.1.1heptan-2-ol, 2,6,6-trimethyl-: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - Bicyclo[3.1.1]heptan-2-ol, 2,6,6-trimethyl-: Human health tier I assessment
Hazards SummaryEmergency treatment: Turpentine oil; [HSDB] A skin irritant; [MSDSonline] See Turpentine. See TERPENES.
Hazard Classes and CategoriesAcute Tox. 4 (60.7%)；Acute Tox. 3 (39.3%)；Acute Tox. 4 (60.7%)；Skin Irrit. 2 (73%)；Eye Irrit. 2 (100%)

Sicherheit und Schutzausrüstung

Disposal Methods · 1 Eintrag

SRP: At the time of review, criteria for land treatment or burial (sanitary landfill) disposal practices are subject to significant revision. Prior to implementing land disposal of waste residue (including waste sludge), consult with environmental regulatory agencies for guidance on acceptable disposal practices.

Regulatorische Informationen

Regulatory Information · 3 Einträge

Chemical: Bicyclo[3.1.1]heptan-2-ol, 2,6,6-trimethyl-

Bicyclo[3.1.1]heptan-2-ol, 2,6,6-trimethyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Bicyclo[3.1.1]heptan-2-ol, 2,6,6-trimethyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Bicyclo3.1.1heptan-2-ol, 2,6,6-trimethyl-: Does not have an individual approval but may be used under an appropriate group standard

Sicherheitsdaten

tsca
TSCA listed
Giftige Stoffe Daten
473-54-1(Hazardous Substances Data)

Chemie und Industrie

Pharmakologische Informationen

Metabolism/MetabolitesA NUMBER OF TERPENOIDS WERE ORALLY ADMIN TO RABBITS, & THE METABOLITES WERE ISOLATED FROM URINE BY VARIOUS CHROMATOGRAPHIC METHODS. THE MAJOR METABOLITE OF PINANE WAS ALPHA-TERPINEOL & MINOR METABOLITES WERE PINAN-2-OL & PINAN-3-OL.

Verwendung und Herstellung

Uses · 3 Einträge

Used as a fragrance and flavoring agent; [HSDB]

CYCLIC TERPENE ALCOHOLS ARE MOSQUITO REPELLENTS

FRAGRANCE & FLAVORING AGENT

U.S. Production · 3 Einträge

2023: <50,000 lb；2022: 50,000 - <250,000 lb；2021: 50,000 - <250,000 lb；2020: <50,000 lb

(1980) MORE THAN 2.27X10+6 G (CIS/TRANS MIXT)

(1981) MORE THAN 2.27X10+6 G (CIS/TRANS MIXT)

Industry UsesIntermediates
Methods of ManufacturingHYDRATION OF ALPHA-PINENE, BETA-PINENE OR AN ISOMERIC MIXTURE
General Manufacturing Information · 2 Einträge

All Other Basic Organic Chemical Manufacturing

Bicyclo[3.1.1]heptan-2-ol, 2,6,6-trimethyl-: ACTIVE

Vor- und nachgelagerte Produkte

Anbieter5 Anbieter

BOC Sciences[email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 17389186172 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]

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