| CAS Number | 42427-51-0 |
| Catalog Number | AG0072GA(AGN-PC-03LCGK) |
| Chemical Name | 1-Bromo-4-(but-1-en-2-yl)benzene |
| IUPAC Name | 1-bromo-4-but-1-en-2-ylbenzene |
| InChI | InChI=1S/C10H11Br/c1-3-8(2)9-4-6-10(11)7-5-9/h4-7H,2-3H2,1H3 |
| InChI Key | RGATWDYVVSRVCF-UHFFFAOYSA-N |
| MDL Number | MFCD20384655 |
| Molecular Formula | C10H11Br |
| Molecular Weight | 211.0983 |
| SMILES | CCC(C1=CC=C(Br)C=C1)=C |
| Synonyms | 1-bromo-4-(but-1-en-2-yl)benzene,
42427-51-0,
Benzene, 1-bromo-4-(1-methylenepropyl)-,
alpha-Ethyl-4-bromostyrene,
SCHEMBL5178198,
CTK1D3206,
DTXSID30623100,
RGATWDYVVSRVCF-UHFFFAOYSA-N,
ZINC82163990,
1-Bromo-4-(1-methylenepropyl)benzene,
AKOS013993824,
FCH5628928,
NE43224,
1-bromo-4-(1-methylenepropyl)-benzene,
BBV-39177928,
EN300-113105,
1-bromo-4-but-1-en-2-ylbenzene,
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| Complexity | 132 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 210.004g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.102g/mol |
| Monoisotopic Mass | 210.004g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number