Basic information
- CAS
20044-46-6- Standard SMILES
CC(O)c1cccc(F)c1- InChIKey
YESOPGLEIJQAEF-UHFFFAOYSA-N- Molecular formula
- C8H9FO
- Average molar mass
- 140.15 g/mol
- Monoisotopic mass
- 140.06374313
Names & identifiers
- Preferred name
- 3-Fluoro-alpha-methylbenzenemethanol
- IUPAC
- 1-(3-fluorophenyl)ethanol
- English name
- 1-(2-Fluorophenyl)ethanol
- Molecular formula
- C8H9FO
- Molecular weight
- 140.1548632
Names & synonyms
402-63-13-Fluoro-alpha-methylbenzyl alcohol3-Fluoro-alpha-methylbenzenemethanolRefChem:1067833206-950-41-(3-Fluorophenyl)ethanol1-(3-fluorophenyl)ethan-1-olMFCD000144023-FLUOROPHENYL METHYL CARBINOL3-Fluorophenylmethylcarbinol20044-46-6Benzenemethanol, 3-fluoro-.alpha.-methyl-
Show more names
NSC2996NSC-2996S-MF-PELEINECS 206-950-4Benzenemethanol, 3-fluoro-alpha-methyl-m-FluorophenylmethylcarbinolHWV28Z9V4PSCHEMBL508016
Database identifiers
- CAS
20044-46-6、402-63-1- PubChem CID
- 95348
- DTXSID
DTXSID80942055- UNII
- HWV28Z9V4P
- EC Number
- 206-950-4
- Nikkaji
- J142.887J
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 105
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 6 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Chemistry & industry
Suppliers55 total
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
河南赢创生物科技有限公司16650615803 · [email protected]
上海药森生物科技有限公司18916117619 18916117619 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海辅欣医药科技有限公司+86-021-021-50872116 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
上海珂华生物科技有限公司021-60455363 18019463053 · [email protected]
北京伊诺凯科技有限公司15652467323 · [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
Related reactions
16 records
Compound notes
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