| CAS Number | 1147014-97-8 |
| Catalog Number | AG0094L2 |
| Chemical Name | 4-BroMo-1-iodo-2-isopropylbenzene |
| IUPAC Name | 4-bromo-1-iodo-2-propan-2-ylbenzene |
| InChI | InChI=1S/C9H10BrI/c1-6(2)8-5-7(10)3-4-9(8)11/h3-6H,1-2H3 |
| InChI Key | LDOHQLFWSINTRJ-UHFFFAOYSA-N |
| MDL Number | MFCD11845959 |
| Molecular Formula | C9H10BrI |
| Molecular Weight | 324.9842 |
| SMILES | CC(C)C1=C(C=CC(=C1)Br)I |
| Synonyms | 5-Bromo-2-iodoisopropylbenzene,
1147014-97-8,
4-BROMO-1-IODO-2-ISOPROPYLBENZENE,
SCHEMBL3979806,
DTXSID40679219,
MFCD11845959,
ZINC65356381,
AKOS015951054,
4-Bromo-1-iodo-2-(propan-2-yl)benzene,
AK192963,
DS-10361,
4-Bromo-1-iodo-2-(1-methylethyl)benzene,
AB1007866,
DB-060630,
FT-0757631,
Y3717,
Q-7140,
null,
C9H10BrI,
|
| Complexity | 125 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 323.901g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 324.987g/mol |
| Monoisotopic Mass | 323.901g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number