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Cas Database |
| Name |
4-(1-Ethyl-2-(4-methoxyphenyl)-1-butenyl)phenol (E)- |
EINECS | N/A |
| CAS No. | 18839-90-2 | Density | 1.054g/cm3 |
| PSA | 29.46000 | LogP | 5.13160 |
| Solubility | N/A | Melting Point |
116-117.5° |
| Formula | C18H20O2 | Boiling Point | 413.1°Cat760mmHg |
| Molecular Weight | 282.382 | Flash Point | 192.2°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Mutation data reported. When heated to decomposition it emits acrid smoke and irritating vapors. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
PHENOL, 4-(1-ETHYL-2-(4-METHOXYPHENYL)-1-BUTENYL)-, (E)-;4-STILBENOL, α-α′-DIETHYL-4′-METHOXY-, (E)-(8CI); |
Article Data | 11 |
4-(1-Ethyl-2-(4-methoxyphenyl)-1-butenyl)phenol (E)- Chemical Properties
Product Name: 4-(1-Ethyl-2-(4-methoxyphenyl)-1-butenyl)phenol (E)- (CAS NO.18839-90-2)
Molecular Formula: C18H20O2
Molecular Weight: 268.38g/mol
Mol File: 18839-90-2.mol
Boiling point: 413.1 °C at 760 mmHg
Flash Point: 192.2 °C
Density: 1.054 g/cm3
Surface Tension: 39.9 dyne/cm
Enthalpy of Vaporization: 69.16 kJ/mol
Vapour Pressure: 2.06E-07 mmHg at 25°C
XLogP3-AA: 5.4
H-Bond Donor: 1
H-Bond Acceptor: 2
Structure Descriptors of 4-(1-Ethyl-2-(4-methoxyphenyl)-1-butenyl)phenol (E)- (CAS NO.18839-90-2):
IUPAC Name: 4-[(E)-4-(4-methoxyphenyl)hex-3-en-3-yl]phenol
Canonical SMILES: CCC(=C(CC)C1=CC=C(C=C1)OC)C2=CC=C(C=C2)O
Isomeric SMILES: CC/C(=C(/CC)\C1=CC=C(C=C1)OC)/C2=CC=C(C=C2)O
InChI: InChI=1S/C19H22O2/c1-4-18(14-6-10-16(20)11-7-14)19(5-2)15-8-12-17(21-3)13-9-15/h6-13,20H,4-5H2,1-3H3/b19-18+
InChIKey: CKMDPZMWUZDKAI-VHEBQXMUSA-N
4-(1-Ethyl-2-(4-methoxyphenyl)-1-butenyl)phenol (E)- Toxicity Data With Reference
| 1. | sln-ham-lng 30 µmol/L | MUREAV Mutation Research. 263 (1991),269. |
4-(1-Ethyl-2-(4-methoxyphenyl)-1-butenyl)phenol (E)- Safety Profile
Mutation data reported. When heated to decomposition it emits acrid smoke and irritating vapors.
4-(1-Ethyl-2-(4-methoxyphenyl)-1-butenyl)phenol (E)- Specification
4-(1-Ethyl-2-(4-methoxyphenyl)-1-butenyl)phenol (E)- , its CAS NO. is 18839-90-2, the synonyms are Mestilbol ; 3-p-Hydroxyphenyl-4-p-methoxyphenyl-3-hexene ; Diethylstilbestrol monomethyl ether Monomestrol ; alpha,alpha-Diethyl-4'-methoxy-4-stilbenol ; trans-Diethylstilbestrol monomethyl ether ; 4-Stilbenol, alpha,alpha'-diethyl-4'-methoxy-, (E)- (8CI) ; Phenol, 4-((1E)-1-ethyl-2-(4-methoxyphenyl)-1-butenyl)- ; Phenol, 4-(1-ethyl-2-(4-methoxyphenyl)-1-butenyl)-, (E)- .
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