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CAS No.: | 627-18-9 |
---|---|
Name: | 3-Bromo-1-propanol |
Article Data: | 39 |
Molecular Structure: | |
Formula: | C3H7BrO |
Molecular Weight: | 138.992 |
Synonyms: | 1-Propanol, 3-bromo-;3-Bromopropan-1-ol;3-Hydroxypropyl bromide;1-Propanol,3-bromo-;4-01-00-01446 (Beilstein Handbook Reference);Trimethylene bromohydrin;4-amino uracil; |
EINECS: | 210-986-6 |
Density: | 1.566 g/cm3 |
Boiling Point: | 175.3 °C at 760 mmHg |
Flash Point: | 93.9 °C |
Solubility: | 167 g/L (20 °C) in water |
Appearance: | colourless liquid |
Hazard Symbols: | Xn, Xi |
Risk Codes: | 22-41-36/37/38 |
Safety: | 26-39-37/39 |
PSA: | 20.23000 |
LogP: | 0.76370 |
1-bromo-3-propanol
Conditions | Yield |
---|---|
With Oxone; water In acetone at 20℃; for 0.0333333h; | 98% |
3-(tetrahydro-2H-pyran-2-yloxy)propyl bromide
1-bromo-3-propanol
Conditions | Yield |
---|---|
With silica-supported NaHSO4 In methanol at 20℃; for 0.25h; | 93% |
Conditions | Yield |
---|---|
With hydrogen bromide In benzene for 20h; Heating; | 90% |
With hydrogen bromide In water; benzene for 28h; Heating; | 79% |
With tetrabutylammomium bromide; hydrogen bromide In water for 0.0833333h; Microwave irradiation; | 75% |
3-(tert-butyldimethylsilyloxy)propyl bromide
1-bromo-3-propanol
Conditions | Yield |
---|---|
With Selectfluor In acetonitrile at 150℃; for 0.0833333h; Microwave irradiation; | 83% |
With methanol; trimethylsilyl bromide at 20℃; for 0.0833333h; chemoselective reaction; | 83% |
Conditions | Yield |
---|---|
With zinc(II) tetrahydroborate In tetrahydrofuran at 67℃; for 2h; | 79% |
Conditions | Yield |
---|---|
With dimethylboron bromide; triethylamine In dichloromethane at 0℃; for 2h; | 78% |
With sodium bromide at 50℃; for 18h; Green chemistry; | 29% |
With diethyl ether; magnesium bromide zuletzt in Benzol bei Siedetemperatur; |
Conditions | Yield |
---|---|
With zinc(II) tetrahydroborate In tetrahydrofuran for 6h; Heating; | 75% |
trimethylene oxide
ethylmagnesium bromide
A
pentan-1-ol
B
1-bromo-3-propanol
Conditions | Yield |
---|---|
With diethyl ether |
Product Name: 3-Bromo-1-propanol (CAS NO.627-18-9)
Molecular Formula: C3H7BrO
Molar mass:138.99108 g/mol
Density: 1.566 g/cm3
Flash Point: 93.9 °C
Boiling Point: 175.3 °C at 760 mmHg
Index of Refraction:1.48
Vapour Pressure: 0.357 mmHg at 25°C
Water solubility: 167 g/L (20°C)
Storage temp: 2-8°C
Appearance: colourless liquid
XLogP3-AA: 0.7
H-Bond Donor: 1
H-Bond Acceptor: 1
Structure Descriptors of 3-Bromo-1-propanol (CAS NO.627-18-9):
IUPAC Name: 3-bromopropan-1-ol
Canonical SMILES: C(CO)CBr
InChI: InChI=1S/C3H7BrO/c4-2-1-3-5/h5H,1-3H2
InChIKey: RQFUZUMFPRMVDX-UHFFFAOYSA-N
Product Categories: Aliphatics; Halides; omega-Bromoalkanols; omega-Functional Alkanols, Carboxylic Acids, Amines & Halides
3-Bromo-1-propanol (CAS NO.627-18-9) can be used as a raw material in organic synthesis ,and is an important chemical intermediate.
1. | mmo-sat 177 µg/plate | MUREAV Mutation Research. 57 (1978),381. |
Mutation data reported. When heated to decomposition it emits toxic fumes of Br−. See also BROMIDES.
Hazard Codes:Xn,Xi
Risk Statements:
22: Harmful if swallowed
36: Irritating to the eyes
37: Irritating to the respiratory system
38: Irritating to the skin
41: In case of fire and/or explosion do not breathe fumes
Safety Statements:
26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
37: Wear suitable gloves
39: Wear eye/face protection
3-Bromo-1-propanol , its CAS NO. is 627-18-9, the synonyms are 3-Bromopropan-1-ol ; 3-Hydroxypropyl bromide ; Trimethylene bromohydrin ; 1-Propanol, 3-bromo- ; 1-Bromo-3-propanol .