5-Hydroxypentan-2-on

5-Hydroxy-2-pentanone

HCID 14066CAS 1071-73-4

Grundinformationen

Standard-SMILES
CC(=O)CCCO
InChIKey
JSHPTIGHEWEXRW-UHFFFAOYSA-N
Summenformel
C5H10O2
Durchschnittliche Molmasse
102,13 g/mol
Monoisotopische Masse
102,06807956

Namen und Bezeichner

Bevorzugter Name
5-Hydroxy-2-pentanone
IUPAC
5-hydroxypentan-2-one
Lokaler Name
5-Hydroxypentan-2-on
Englischer Name
3-Acetyl-1-propanol
Summenformel
C5H10O2
Molmasse
102.13

Namen und Synonyme

1071-73-45-Hydroxy-2-pentanoneAcetopropyl alcoholDTXSID30147917RefChem:109017DTXCID9070408213-994-83-Acetyl-1-propanol5-Hydroxypentan-2-one3-Acetopropanol3-Acetylpropanol2-Pentanone, 5-hydroxy-
Weitere Namen anzeigen
Hydroxypentanone-Acetopropanol-Acetylpropanol
gamma-Acetopropanol4-Oxo-1-pentanolPROPANOL, 3-ACETYL-MFCD000029615-hydroxy-pentan-2-onegamma-Acetylpropyl alcohol.gamma.-AcetopropanolNSC 19158

Datenbank-Bezeichner

CAS
1071-73-4
PubChem CID
14066
DTXSID
DTXSID30147917
ChEBI
CHEBI:195472
EC Number
213-994-8
Nikkaji
J35.474K

Eigenschaften

Berechnete Struktureigenschaften

XLogP
-0,4
Polarare Oberfläche (TPSA)
37,3 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
2
Frei drehbare Bindungen
3
Schwere Atome
7

Experimentelle und physikochemische Eigenschaften

Physical DescriptionColorless liquid; [Sigma-Aldrich MSDS]
Kovats Retention Index687

Physikochemische Eigenschaften

Schmelzpunkt
2.5 °C · 2.5°C (estimate)
Siedepunkt
144 · 144-145 °C/100 mmHg (lit.)
Dichte
1.007 g/mL · 1.007 g/mL at 25 °C (lit.)
Brechungsindex
20 · n20/D 1.437(lit.)
Flammpunkt
200 °F · 200 °F
storage temp.
2 · 2-8°C

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 3 Einträge

This chemical does not meet GHS hazard criteria for 97.3% (72 of 74) of all reports.

Not Classified;Reported as not meeting GHS hazard criteria by 72 of 74 companies (only 2.7% companies provided GHS information). For more detailed information, please visit ECHA C&L website.

Aggregated GHS information provided per 74 reports by companies from 2 notifications to the ECHA C&L Inventory.;Reported as not meeting GHS hazard criteria per 72 of 74 reports by companies.;There is 1 notification provided by 2 of 74 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

Hazards Summary · 1 Eintrag

Causes diffuse hepatitis and somnolence in oral lethal-dose studies of mice; Causes abnormal liver function tests, changes in recordings from peripheral motor nerve, weight loss, degenerative changes to brain, and optic nerve neuropathy in repeated-dose inhalation studies of rats; [RTECS] May cause irritation; [Sigma-Aldrich MSDS] See Diacetone alcohol.

Hazard Classes and CategoriesNot Classified

Toxikologische Informationen

Adverse EffectsNeurotoxin - Acute solvent syndrome;Occupational hepatotoxin - Secondary hepatotoxins: the potential for toxic effect in the occupational setting is based on cases of poisoning by human ingestion or animal experimentation.
Toxicity DataLC (rat) > 2,000 mg/m3/4hr

Sicherheitsdaten

wgk
2
hs_code
29144000
RTECS-Nr.
UA4600000
risk_code
36/37/38
Toxizität
LD50 orl-rat: 6400 mg/k TNICS* 13,118,73
hazard_code
Xi

Chemie und Industrie

Anbieter50 Anbieter

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]
河北创海生物科技有限公司+86-86-13131129325 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]

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