4'-Decyloxybiphenyl-4-carboxylic Acid
Grundinformationen
- CAS
69367-32-4- Standard-SMILES
CCCCCCCCCCOc1ccc(-c2ccc(C(=O)O)cc2)cc1- InChIKey
HQVTYOXUVQQMLD-UHFFFAOYSA-N- Summenformel
- C23H30O3
- Durchschnittliche Molmasse
- 354,5 g/mol
- Monoisotopische Masse
- 354,21949482
Namen und Bezeichner
- Bevorzugter Name
- 4'-Decyloxybiphenyl-4-carboxylic Acid
- IUPAC
- 4-(4-decoxyphenyl)benzoic acid
- Englischer Name
- 4'-N-DECYLOXYBIPHENYL-4-CARBOXYLIC ACID
- Summenformel
- C23H30O3
- Molmasse
- 354.48
Namen und Synonyme
69367-32-44'-Decyloxybiphenyl-4-carboxylic AcidDTXSID60466345RefChem:283411DTXCID50417164678-114-04-(4-decoxyphenyl)benzoic Acid4'-(decyloxy)-[1,1'-biphenyl]-4-carboxylic acid4-Decyloxybiphenyl-4-carboxylic Acid ,MFCD00130126SCHEMBL58286404'-n-Decyloxy-4-carboxybiphenyl
Weitere Namen anzeigen
Decyloxybiphenylcarboxylicacid4'-N-DECYLOXYBIPHENYL-4-CARBOXYLIC ACID4'-(Decyloxy)-1,1'-biphenyl-4-carboxylic acid[1,1'-Biphenyl]-4-carboxylic acid, 4'-(decyloxy)-4′-Decyloxybiphenyl-4-carboxylic Acid, CAS 69367-32-4
4-(4-Decyloxyphenyl)benzoic acid4'-decyloxy-4-biphenylcarboxylic acidAKOS0158397974-n-decyloxy-4'-biphenylcarboxylic acid4-n-decyloxybiphenyl-4'-carboxylic acidSY0561834'-(decyloxy)-4-biphenyl-carboxylic acidD2041
Datenbank-Bezeichner
- CAS
69367-32-4- PubChem CID
- 11451085
- DTXSID
DTXSID60466345- EC Number
- 678-114-0
- Nikkaji
- J256.507B
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 7,7
- Polarare Oberfläche (TPSA)
- 46,5 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 12
- Schwere Atome
- 26
- Formalladung
- 0
- Komplexität
- 366
Physikochemische Eigenschaften
- Schmelzpunkt
- 171.6 · 171.6-172.5 °C
- Siedepunkt
- 505.964 · 505.964±43.00 °C(Press: 760.00 Torr)(predicted)
- Dichte
- 1.043 · 1.043±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 4.275 · 4.275±0.10(predicted)
- Aggregatzustand
- powder to crystal
- Farbe
- White to Almost white
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Gefahrenhinweise
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Sicherheitsdaten
- hs_code
- 2918.29.7500
- risk_code
- 36/37/38
- safety_code
- 26-36/37/39
Chemie und Industrie
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