4-(2-Bromophenyl)-2-methyl-1-butene - CAS 130955-17-8
Catalog: |
BB007205 |
Product Name: |
4-(2-Bromophenyl)-2-methyl-1-butene |
CAS: |
130955-17-8 |
Synonyms: |
1-bromo-2-(3-methylbut-3-enyl)benzene |
IUPAC Name: | 1-bromo-2-(3-methylbut-3-enyl)benzene |
Description: | 4-(2-Bromophenyl)-2-methyl-1-butene (CAS# 130955-17-8) is a useful research chemical compound. |
Molecular Weight: | 225.12 |
Molecular Formula: | C11H13Br |
Canonical SMILES: | CC(=C)CCC1=CC=CC=C1Br |
InChI: | InChI=1S/C11H13Br/c1-9(2)7-8-10-5-3-4-6-11(10)12/h3-6H,1,7-8H2,2H3 |
InChI Key: | AYBPGVKOKLIVNY-UHFFFAOYSA-N |
Boiling Point: | 253.7 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.215 g/mL at 25°C(lit.) |
MDL: | MFCD00671886 |
LogP: | 3.95780 |
GHS Hazard Statement: | H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard] |
Precautionary Statement: | P273, P391, and P501 |
Signal Word: | Warning |
Complexity: | 151 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 224.02006 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 224.02006 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.6 |
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