3-Bromo-2-methyl-2-propen-1-ol - CAS 89089-31-6
Catalog: |
BB039344 |
Product Name: |
3-Bromo-2-methyl-2-propen-1-ol |
CAS: |
89089-31-6 |
Synonyms: |
3-bromo-2-methyl-2-propen-1-ol; 3-bromo-2-methylprop-2-en-1-ol |
IUPAC Name: | (E)-3-bromo-2-methylprop-2-en-1-ol |
Description: | 3-Bromo-2-methyl-2-propen-1-ol (CAS# 89089-31-6) is a compound useful in organic synthesis. |
Molecular Weight: | 151.00 |
Molecular Formula: | C4H7BrO |
Canonical SMILES: | CC(=CBr)CO |
InChI: | InChI=1S/C4H7BrO/c1-4(2-5)3-6/h2,6H,3H2,1H3 |
InChI Key: | VFZCSFMDONRPQB-UHFFFAOYSA-N |
Boiling Point: | 170 °C at 760 mmHg |
Density: | 1.53 g/cm3 |
MDL: | MFCD00154044 |
LogP: | 1.27740 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P280, P301+P310, P305+P351+P338, P321, P330, P337+P313, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
US-6747011-B1 | Antitumor drugs and methods | 20030604 |
Complexity: | 58.6 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 149.96803 |
Formal Charge: | 0 |
Heavy Atom Count: | 6 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 149.96803 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 20.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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