Basic information
- CAS
91054-27-2- Standard SMILES
CC(Oc1cccc(F)c1)C(=O)O- InChIKey
HHNWBAYKSQUOFN-UHFFFAOYSA-N- Molecular formula
- C9H9FO3
- Average molar mass
- 184.16 g/mol
- Monoisotopic mass
- 184.05357237
Names & identifiers
- Preferred name
- 2-(3-Fluorophenoxy)propanoic acid
- IUPAC
- 2-(3-fluorophenoxy)propanoic acid
- English name
- 2-(3-FLUORO-PHENOXY)-PROPIONIC ACID
- Molecular formula
- C9H9FO3
- Molecular weight
- 184.16
Names & synonyms
2-(3-fluorophenoxy)propanoic acidRefChem:455558855-356-791054-27-22-(3-Fluoro-phenoxy)-propionic acidMFCD02295724orb3029696SCHEMBL14323732-(3-fluorophenoxy)propanoicacidDTXSID80424326HHNWBAYKSQUOFN-UHFFFAOYSA-NRDA05427
Show more names
TIMTEC-BB SBB010711ASINEX-REAG BAS 01163042Propanoic acid, 2-(3-fluorophenoxy)-
2-(3'-fluorophenoxy)propionic acidFr212989SBB010711STK3179242-(3' -fluorophenoxy)propionic acidAKOS000103529AKOS022063969SY060770
Database identifiers
- CAS
91054-27-2- PubChem CID
- 6483762
- DTXSID
DTXSID80424326- EC Number
- 855-356-7
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 184
Physicochemical properties
- storage temp.
- Store at Room Tem.
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H302-H319-H335
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H315-H302-H319-H335
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers12 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
上海安米克化学品有限公司微信 17321281695 18019252918 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
西安峥鎏生物科技有限公司15594552852 · [email protected]
济宁一泽医药科技有限公司15192473210 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
济南光尘医药科技有限公司18563726319 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海研邦医药科技有限公司15618536883 · [email protected]
武汉万鉴生物科技有限公司13277087647 · [email protected]
Related reactions
3 records
Compound notes
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