3-Bromo-1,1,1-trichloropropane - CAS 13749-37-6
Catalog: |
BB008578 |
Product Name: |
3-Bromo-1,1,1-trichloropropane |
CAS: |
13749-37-6 |
Synonyms: |
3-bromo-1,1,1-trichloropropane |
IUPAC Name: | 3-bromo-1,1,1-trichloropropane |
Description: | 3-Bromo-1,1,1-trichloropropane (CAS# 13749-37-6 ) is a useful research chemical. |
Molecular Weight: | 226.33 |
Molecular Formula: | C3H4BrCl3 |
Canonical SMILES: | C(CBr)C(Cl)(Cl)Cl |
InChI: | InChI=1S/C3H4BrCl3/c4-2-1-3(5,6)7/h1-2H2 |
InChI Key: | PUNXOOKBNWKKKR-UHFFFAOYSA-N |
Boiling Point: | 113-114 °C (lit.) |
Purity: | 95 % |
Density: | 1.762 g/mL at 25 °C(lit.) |
MDL: | MFCD00239389 |
LogP: | 3.14160 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
TW-201402545-A | Novel diaza spirocycloalkane and azaspirocycloalkane | 20120613 |
TW-201124365-A | Heterocycle-containing asymmetric aromatic compound, compound for organic thin film transistor, and organic thin film transistor using same | 20091105 |
JP-2010235594-A | Alkylsulfone derivatives | 20090310 |
AU-2009228778-A1 | Hydroxamate-based inhibitors of deacetylases B | 20080326 |
AU-2009228778-B2 | Hydroxamate-based inhibitors of deacetylases B | 20080326 |
Complexity: | 48.6 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 223.8562 |
Formal Charge: | 0 |
Heavy Atom Count: | 7 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 223.8562 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 0 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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