| CAS Number | 915922-40-6 |
| Catalog Number | AG00GTRL(AGN-PC-0WB4UC) |
| Chemical Name | (3-Bromo-4-propoxyphenyl)methanol |
| IUPAC Name | (3-bromo-4-propoxyphenyl)methanol |
| InChI | InChI=1S/C10H13BrO2/c1-2-5-13-10-4-3-8(7-12)6-9(10)11/h3-4,6,12H,2,5,7H2,1H3 |
| InChI Key | VZQSVBPBYWZHCP-UHFFFAOYSA-N |
| MDL Number | MFCD08691776 |
| Molecular Formula | C10H13BrO2 |
| Molecular Weight | 245.1130 |
| SMILES | C1(Br)C=C(CO)C=CC=1OCCC |
| Synonyms | (3-BROMO-4-PROPOXYPHENYL)METHANOL,
915922-40-6,
CHEMBRDG-BB 7573402,
SCHEMBL3718915,
CTK5H0035,
DTXSID20651078,
VZQSVBPBYWZHCP-UHFFFAOYSA-N,
ZX-CM017415,
Benzenemethanol, 3-bromo-4-propoxy-,
MFCD08691776,
ZINC19094019,
AKOS012351356,
AJ-72295,
BBV-36850056,
Y-4434,
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| Complexity | 141 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 244.01g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 245.116g/mol |
| Monoisotopic Mass | 244.01g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number