| CAS Number | 1211596-34-7 |
| Catalog Number | AG00A5LD(AGN-PC-0WALY5) |
| Chemical Name | 3-(4-Bromophenyl)tetrahydrofuran-3-amine |
| IUPAC Name | 3-(4-bromophenyl)oxolan-3-amine |
| InChI | InChI=1S/C10H12BrNO/c11-9-3-1-8(2-4-9)10(12)5-6-13-7-10/h1-4H,5-7,12H2 |
| InChI Key | HCUJKBQOANWEKI-UHFFFAOYSA-N |
| MDL Number | MFCD11109726 |
| Molecular Formula | C10H12BrNO |
| Molecular Weight | 242.1124 |
| SMILES | BrC1=CC=C(C=C1)C1(COCC1)N |
| Synonyms | 3-(4-Bromophenyl)tetrahydrofuran-3-amine,
1211596-34-7,
3-(4-bromophenyl)oxolan-3-amine,
SCHEMBL19330910,
CTK5I7161,
DTXSID60724891,
ANW-64425,
MFCD11109726,
AKOS016006224,
KS-0000052T,
AS-50774,
TC-153170,
CS-0051745,
3-(4-BROMOPHENYL)-TETRAHYDROFURAN-3-AMINE,
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| Complexity | 180 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 241.01g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 242.116g/mol |
| Monoisotopic Mass | 241.01g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number