| CAS Number | 110124-11-3 |
| Catalog Number | AG01A2RO(AGN-PC-0JM9LP) |
| Chemical Name | 2-Bromo-4-methyl-1-[(2-methylprop-2-en-1-yl)oxy]benzene |
| IUPAC Name | 2-bromo-4-methyl-1-(2-methylprop-2-enoxy)benzene |
| InChI | InChI=1S/C11H13BrO/c1-8(2)7-13-11-5-4-9(3)6-10(11)12/h4-6H,1,7H2,2-3H3 |
| InChI Key | AOZJFZHICRGAOX-UHFFFAOYSA-N |
| MDL Number | MFCD11156059 |
| Molecular Formula | C11H13BrO |
| Molecular Weight | 241.1243 |
| NSC Number | 338429 |
| SMILES | CC(COC1=C(Br)C=C(C)C=C1)=C |
| Synonyms | 2-bromo-4-methyl-1-[(2-methylprop-2-en-1-yl)oxy]benzene,
110124-11-3,
NSC338429,
AC1L7ENY,
SCHEMBL5752867,
AOZJFZHICRGAOX-UHFFFAOYSA-N,
ZINC1578079,
AKOS000261905,
BBV-155110,
FCH5114637,
NE61821,
NSC-338429,
EN300-118659,
2-bromo-4-methyl-1-(2-methylprop-2-enoxy)benzene,
2-bromo-4-methyl-1-[(2-methyl-2-propenyl)oxy]benzene,
CID334095,
|
| Complexity | 179 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 240.015g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.128g/mol |
| Monoisotopic Mass | 240.015g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number