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2-phenoxyethanol
CAS No. 122-99-6
SMILES C1=CC=CC(OCCO)=C1
Временной период поиска: по умолчанию

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SF

Experimental Properties: Biological Chemical Density Lipinski and Related Optical and Scattering Spectra Thermal
Top Biological Properties Value Condition Note
LC50 See full text (32) CAS
LC50 See full text (33) CAS
Median Lethal Dose(LD50) 16500 mg/kg Organism: mouse Route: oral (38) CAS
Median Lethal Dose(LD50) 13700 mg/kg Organism: rat Route: oral (38) CAS
Median Lethal Dose(LD50) 1.26 mg/kg Organism: rat Route: oral (8) APC
Top Chemical Properties Value Condition Note
logP See full text (34) CAS
Partition Coefficient See full text (42) IC
Partition Coefficient See full text (43) IC
Partition Coefficient See full text (44) IC
Solubility See full text (34) CAS
Top Density Properties Value Condition Note
Density 1.1111 g/cm3 Temp: 20 °C (16) CAS
Density 1.1094 g/cm3 Temp: 20 °C (2) NLM
Density 1.1 g/cm3 (4) NIOSH
Density See full text (28) CAS
Top Lipinski and Related Properties Value Condition Note
logP See full text (34) CAS
Top Optical and Scattering Properties Value Condition Note
Refractive Index 1.5370 Wavlen: 589.3 nm; Temp: 20 °C (16) CAS
Refractive Index 1.5360 Wavlen: 589.3 nm; Temp: 20 °C (13) CAS
Refractive Index 1.5358 Wavlen: 589.3 nm; Temp: 20 °C (21) CAS
Refractive Index 1.5349 Wavlen: 589.3 nm; Temp: 20 °C (46) CAS
Refractive Index 1.534 Wavlen: 589.3 nm; Temp: 20 °C (2) NLM
Refractive Index 1.5332 Wavlen: 589.3 nm; Temp: 20 °C (13) CAS
Refractive Index 1.533 Wavlen: 589.3 nm; Temp: 25 °C (3) CAS
Refractive Index 1.5318 Temp: 20 °C (18) IC
Refractive Index See full text (28) CAS
Top Spectra Properties Value Condition Note
Carbon-13 NMR Spectrum See spectrum (22) WSS
Carbon-13 NMR Spectrum See spectrum (22) WSS
Carbon-13 NMR Spectrum See spectrum (22) WSS
Carbon-13 NMR Spectrum See spectrum (22) WSS
Carbon-13 NMR Spectrum See spectrum (23) WSS
Carbon-13 NMR Spectrum See spectrum (24) AIST
Carbon-13 NMR Spectrum See full text (25) CAS
Carbon-13 NMR Spectrum See full text (26) CAS
Carbon-13 NMR Spectrum See full text (27) CAS
IR Absorption Spectrum See spectrum (24) AIST
IR Absorption Spectrum See spectrum (24) AIST
IR Absorption Spectrum See spectrum (29) BIORAD
IR Absorption Spectrum See spectrum (29) BIORAD
IR Absorption Spectrum See spectrum (29) BIORAD
IR Absorption Spectrum See spectrum (29) BIORAD
IR Absorption Spectrum See spectrum (29) BIORAD
IR Absorption Spectrum See spectrum (29) BIORAD
IR Absorption Spectrum See spectrum (29) BIORAD
IR Absorption Spectrum See spectrum (29) BIORAD
IR Absorption Spectrum See spectrum (29) BIORAD
IR Absorption Spectrum See spectrum (29) BIORAD
IR Absorption Spectrum See spectrum (29) BIORAD
IR Absorption Spectrum See spectrum (22) WSS
IR Absorption Spectrum See spectrum (22) WSS
IR Absorption Spectrum See spectrum (22) WSS
IR Absorption Spectrum See spectrum (22) WSS
IR Absorption Spectrum See full text (27) CAS
IR Absorption Spectrum See full text (26) CAS
IR Absorption Spectrum See full text (25) CAS
IR Absorption Spectrum See full text (30) IC
IR Absorption Spectrum See full text (31) CAS
Mass Spectrum See spectrum (22) WSS
Mass Spectrum See spectrum (22) WSS
Mass Spectrum See spectrum (22) WSS
Mass Spectrum See spectrum (24) AIST
Mass Spectrum See full text (25) CAS
Mass Spectrum See full text (27) CAS
Mass Spectrum See full text (30) IC
Mass Spectrum See full text (35) CAS
Mass Spectrum See full text (36) CAS
Mass Spectrum See full text (37) CAS
Proton NMR Spectrum See spectrum (24) AIST
Proton NMR Spectrum See spectrum (24) AIST
Proton NMR Spectrum See full text (25) CAS
Proton NMR Spectrum See full text (26) CAS
Proton NMR Spectrum See full text (30) IC
Proton NMR Spectrum See full text (27) CAS
Proton NMR Spectrum See full text (45) CAS
Raman Spectrum See spectrum (24) AIST
UV and Visible Absorption Spectrum See full text (25) CAS
Top Thermal Properties Value Condition Note
Boiling Point 1343 °C Press: 18 Torr (1) CAS
Boiling Point 245.2 °C Press: 760 Torr (2) NLM
Boiling Point 245 °C (3) CAS
Boiling Point 245 °C (4) NIOSH
Boiling Point 245 °C (5) SRC
Boiling Point 237 °C (6) CAS
Boiling Point 165 °C (7) CAS
Boiling Point 165 °C Press: 80 Torr (8) APC
Boiling Point 163-167 °C Press: 80 Torr (9) CAS
Boiling Point 137 °C Press: 25 Torr (10) CAS
Boiling Point 137 °C Press: 25 Torr (8) APC
Boiling Point 128-130 °C Press: 20 Torr (11) CAS
Boiling Point 126-127 °C Press: 13 Torr (12) CAS
Boiling Point 118-121 °C Press: 12 Torr (13) CAS
Boiling Point 118-121 °C Press: 15 Torr (14) CAS
Boiling Point 103-105 °C Press: 4 Torr (15) CAS
Boiling Point 100-102 °C Press: 2 Torr (16) CAS
Boiling Point 98-100 °C Press: 7 Torr (17) IC
Boiling Point 90-91 °C Press: 2 Torr (13) CAS
Boiling Point 87-89 °C Press: 0.975 Torr (18) IC
Boiling Point 83-85 °C Press: 0.3 Torr (19) CAS
Boiling Point 77-80 °C Press: 0.5 Torr (20) CAS
Boiling Point 64 °C Press: 0.2 Torr (21) CAS
Melting Point 132 °C (39) CAS
Melting Point 104-105 °C Solv: water (7732-18-5) (40) CAS
Melting Point 65 °C (39) CAS
Melting Point 14 °C (8) APC
Melting Point 14 °C (4) NIOSH
Melting Point 14 °C (2) NLM
Melting Point 14 °C (5) SRC
Melting Point See full text (41) IC

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(2) "Hazardous Substances Data Bank" data are provided by the National Library of Medicine (US)
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(4) "International Chemical Safety Cards" data are provided by the National Institute for Occupational Safety and Health.
(5) "PhysProp" data are provided by Syracuse Research Corporation of Syracuse, New York (US)
(6) D'Alelio, Gaetano F.; US 3247261 1966 CAPLUS
(7) Smith, Richard A.; Journal of the American Chemical Society 1940, V62, P994 CAPLUS
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(14) Abramov, V. S.; Zhurnal Obshchei Khimii 1950, V20, P100-6 CAPLUS
(15) Fourcade, Robert; FR 1273409 1962 CAPLUS
(16) Bliznyuk, N. K.; Zhurnal Obshchei Khimii 1966, V36(3), P480-3 CAPLUS
(17) Okawara, Tadashi; Chemical & Pharmaceutical Bulletin 1988, V36(9), P3628-31 CAPLUS
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(19) Bronnert, D. L. E.; Tetrahedron 1960, V10, P160-3 CAPLUS
(20) Munster, Wilhelm; DE 1096366 1961 CAPLUS
(21) Distler, Harry; DE 1298532 1969 CAPLUS
(22) WSS: Spectral data were obtained from Wiley Subscription Services, Inc. (US)
(23) Bangov, Ivan P.; Organic Magnetic Resonance 1983, V21(7), P443-9 CAPLUS
(24) AIST: Integrated Spectral Database System of Organic Compounds. (Data were obtained from the National Institute of Advanced Industrial Science and Technology (Japan))
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(26) Ram, Ram N.; Journal of Chemical Research 2006, (12), P800-803 CAPLUS
(27) Yamakoshi, Hiroyuki; ACS Medicinal Chemistry Letters 2010, V1(6), P273-276 CAPLUS
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(29) BIORAD: Infrared spectral data from the Bio-Rad/Sadtler IR Data Collection was obtained from Bio-Rad Laboratories, Philadelphia, PA (US). Copyright © Bio-Rad Laboratories. All Rights Reserved.
(30) David, Serge; Journal of Organic Chemistry 1983, V48(4), P441-7 CAPLUS
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(38) Loseva, I. E.; Trudy Azerbaidzhanskogo Nauchno-Issledovatel'skogo Instituta Gigieny Truda i Professional'nykh Zabolevanii im. M. M. Efendi-zade 1974, V9, P28-32 CAPLUS
(39) Davis, M.; Journal of the Chemical Society 1962, P178-91 CAPLUS
(40) Fisher, James W.; GB 678264 1952 CAPLUS
(41) Satomura, Masato; DE 3608080 A1 1986 CAPLUS
(42) Berg, Lloyd; US 4543164 A 1985 CAPLUS
(43) Berg, Lloyd; US 4904346 A 1990 CAPLUS
(44) Berg, Lloyd; US 4488937 A 1984 CAPLUS
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(46) Distler, Harry; DE 1298533 1969 CAPLUS

122-99-6.rar

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Всем большое спасибо.