| CAS Number | 444308-32-1 |
| Catalog Number | AG00DNNX(AGN-PC-0RSS7X) |
| Chemical Name | Benzeneethanol, 4-fluoro-alpha-methyl- (9CI) |
| IUPAC Name | 1-(4-fluorophenyl)propan-2-ol |
| InChI | InChI=1S/C9H11FO/c1-7(11)6-8-2-4-9(10)5-3-8/h2-5,7,11H,6H2,1H3 |
| InChI Key | AKJGNXCUDQDKEB-UHFFFAOYSA-N |
| MDL Number | MFCD11934388 |
| Molecular Formula | C9H11FO |
| Molecular Weight | 154.1814 |
| SMILES | CC(O)CC1=CC=C(F)C=C1 |
| Synonyms | 1-(4-fluorophenyl)propan-2-ol,
444308-32-1,
1-(4-Fluorophenyl)-2-propanol,
(R)-1-(4-Fluorophenyl)propan-2-ol,
Benzeneethanol,4-fluoro-a-methyl-, (aR)-,
ACMC-20n6go,
SCHEMBL2172447,
CTK4I8193,
AKJGNXCUDQDKEB-UHFFFAOYSA-N,
AKOS010013993,
AK450055,
DS-18817,
BENZENEETHANOL, 4-FLUORO-ALPHA-METHYL-,
Benzeneethanol, 4-fluoro-alpha-methyl- (9CI),
CID11182720,
152485-69-3,
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| Complexity | 108 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 154.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 154.184g/mol |
| Monoisotopic Mass | 154.079g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
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Hazard Class
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Hazard statements
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H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number