CAS 125109-85-5 Florhydral (HCID 86209)

Namen und Bezeichner

Bevorzugter Name: Florhydral
IUPAC: 3-(3-propan-2-ylphenyl)butanal
Englischer Name: ISOPROPYLPHENYLBUTANAL
Summenformel: C13H18O
Molmasse: 190.28

Namen und Synonyme

Isopropylphenylbutanal125109-85-5Florhydral3-(3-Isopropylphenyl)butanalbeta-Methyl-3-(1-methylethyl)benzenepropanalDTXSID7051632Z92022479YBenzenepropanal, beta-methyl-3-(1-methylethyl)-RefChem:149863DTXCID8030184412-050-4FlorhydralR

Weitere Namen anzeigen

FlorhydraFlorhydral 87542433-(3-Isopropylphenyl) butanalISOPROPYLPHENYLBUTANAL USP/EP/BP3-[3-(1-Methylethyl)-phenyl]-butanal

3-(3-propan-2-ylphenyl)butanalBenzenepropanal, .beta.-methyl-3-(1-methylethyl)-(S)--Methyl-3-(1-methylethyl)benzenepropanalfloral butanalUNII-Z92022479Y(R)--Methyl-3-(1-methylethyl)benzenepropanalButanal, 3-(3-(1-methylethyl)phenyl)-EC 412-050-4

Datenbank-Bezeichner

CAS: 125109-85-5
PubChem CID: 86209
DTXSID: DTXSID7051632
UNII: Z92022479Y
EC Number: 412-050-4、641-004-8
Nikkaji: J1.563.138D

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 3,1
Polarare Oberfläche (TPSA): 17,1 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 4
Schwere Atome: 14
Formalladung: 0
Komplexität: 174

Experimentelle und physikochemische Eigenschaften

Physical DescriptionLiquid

Physikochemische Eigenschaften

Siedepunkt: 251.3 · 251.3±9.0 °C(Predicted)
Dichte: 0.935 · 0.935±0.06 g/cm3(Predicted)
Dampfdruck: 0.65 Pa · 0.65Pa at 20℃
storage temp.: Hygroscopic, Refrigerator, under inert atmosphere
Geruch (Odor): 100 % · at 100.00 %. floral green muguet linden flower lily of the valley fresh
Geruchsart: floral
Wasserlöslichkeit: 40 mg/L · 40mg/L at 20℃
Henry's Law Constant: 4.9 · 4.9×10-1 mol/(m3Pa) at 25℃, Dupeux et al. (2022)
Kosmetik-Inhaltsstoffe Funktionen: PERFUMINGFRAGRANCE
LogP: 3.1 at · 3.1 at 35℃
EPA chemische Informationen: -3 · Benzenepropanal, .beta.-methyl-3-(1-methylethyl)- (125109-85-5)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

H411: Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P273, P391, and P501 (click each P-code to see the statement)

H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P273, P391, and P501 (click each P-code to see the statement)

Gefahrenhinweise

Regulatory Information · 5 Einträge

Chemical: Benzenepropanal, .beta.-methyl-3-(1-methylethyl)-；Specific Information Requirement: Obligations to provide information apply. You must tell us within 28 days if the circumstances of your importation or manufacture (introduction) are different to those in our assessment.

Benzenepropanal, .beta.-methyl-3-(1-methylethyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzenepropanal, .beta.-methyl-3-(1-methylethyl)- 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)

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Status: Active Update: 31-10-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/30111；Status: No longer Valid Update: 10-05-2011 https://echa.europa.eu/registration-dossier/-/registered-dossier/6040；Status: Active Update: 10-11-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/9059

Î²-Methyl-3-(1-methylethyl)benzenepropanal: 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.

Hazard Classes and Categories · 4 Einträge

Aquatic Chronic 2 (100%)

Skin Irrit. 2 (32.5%)；Aquatic Chronic 2 (67.5%)

Hazardous to the aquatic environment (chronic) - category 2

Aquatic Chronic 2

Regulatorische Informationen

Regulatory Information · 5 Einträge

Chemical: Benzenepropanal, .beta.-methyl-3-(1-methylethyl)-；Specific Information Requirement: Obligations to provide information apply. You must tell us within 28 days if the circumstances of your importation or manufacture (introduction) are different to those in our assessment.

Benzenepropanal, .beta.-methyl-3-(1-methylethyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzenepropanal, .beta.-methyl-3-(1-methylethyl)- 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)

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Status: Active Update: 31-10-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/30111；Status: No longer Valid Update: 10-05-2011 https://echa.europa.eu/registration-dossier/-/registered-dossier/6040；Status: Active Update: 10-11-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/9059

Î²-Methyl-3-(1-methylethyl)benzenepropanal: 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

tsca: TSCA listed
risk_code: 51/53
hazard_code: N
safety_code: 61

Chemie und Industrie

Verwendung und Herstellung

U.S. Production2023: 8,797,521 lb；2022: 9,035,083 lb；2021: 9,262,314 lb；2020: 9,790,752 lb

Consumer UsesFragrance

Industry UsesFragrance

Household ProductsInformation on 39 consumer products that contain Isopropylphenylbutanal in the following categories is provided:；• Auto Products；• Commercial / Institutional；• Inside the Home

Use Classification · 2 Einträge

Fragrance Ingredients

Cosmetics -> Masking

General Manufacturing Information · 2 Einträge

Soap, Cleaning Compound, and Toilet Preparation Manufacturing；All Other Chemical Product and Preparation Manufacturing

Benzenepropanal, .beta.-methyl-3-(1-methylethyl)-: ACTIVE