| CAS Number | 1087415-99-3 |
| Catalog Number | AG00HB89 |
| Chemical Name | 3-(4-BROMOPHENYL)TETRAHYDROFURAN |
| IUPAC Name | 3-(4-bromophenyl)oxolane |
| InChI | InChI=1S/C10H11BrO/c11-10-3-1-8(2-4-10)9-5-6-12-7-9/h1-4,9H,5-7H2 |
| InChI Key | JAVFDQBREKPGPG-UHFFFAOYSA-N |
| MDL Number | MFCD21099831 |
| Molecular Formula | C10H11BrO |
| Molecular Weight | 227.0977 |
| SMILES | C1=C(C=CC(=C1)Br)C2CCOC2 |
| Synonyms | 3-(4-Bromophenyl)tetrahydrofuran,
1087415-99-3,
SCHEMBL15300665,
JAVFDQBREKPGPG-UHFFFAOYSA-N,
MFCD21099831,
Furan, 3-(4-bromophenyl)tetrahydro-,
AKOS015946527,
(+/-)-3-(4-Bromophenyl)tetrahydrofuran,
AS-43044,
FT-0744318,
|
| Complexity | 141 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 225.999g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.101g/mol |
| Monoisotopic Mass | 225.999g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number