Basic information
- CAS
628732-48-9- Standard SMILES
O=C(O)C1CCc2cc(F)ccc21- InChIKey
AXUVBHSQWRRJSD-UHFFFAOYSA-N- Molecular formula
- C10H9FO2
- Average molar mass
- 180.17 g/mol
- Monoisotopic mass
- 180.05865775
Names & identifiers
- Preferred name
- 5-fluoro-2,3-dihydro-1H-indene-1-carboxylic acid
- IUPAC
- 5-fluoro-2,3-dihydro-1H-indene-1-carboxylic acid
- English name
- 2,3-Dihydro-5-fluoro-1H-indene-1-carboxylic acid
- Molecular formula
- C10H9FO2
- Molecular weight
- 180.18
Names & synonyms
628732-48-95-FLUORO-2,3-DIHYDRO-1H-INDENE-1-CARBOXYLIC ACIDDTXSID50621204RefChem:303106DTXCID10571958881-849-1MFCD112197235-fluoro-indan-1-carboxylic acid2,3-DIHYDRO-5-FLUORO-1H-INDENE-1-CARBOXYLIC ACID1H-Indene-1-carboxylic acid, 5-fluoro-2,3-dihydro-SCHEMBL13377755-fluoroindan-1-carboxylic acid
Show more names
5-Fluoro-1-indancarboxylic acid5-fluoroindane-1-carboxylic acidAXUVBHSQWRRJSD-UHFFFAOYSA-NAKOS006306723AS-39217CS-0239702EN300-2179715-fluoro-2,3-dihydro-1H-inden-1-carboxylic acid
Database identifiers
- CAS
628732-48-9- PubChem CID
- 21986118
- DTXSID
DTXSID50621204- EC Number
- 881-849-1
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 217
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H335-H315-H302
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P
Safety & regulation
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 statements
- H319-H335-H315-H302
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers8 total
南通菡芳生物科技有限公司[email protected] 18017580634 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
天津林宸科技有限公司15122256084 15122256084 · [email protected]
Aceschem Inc.+1-817863-6948 +1-（817）863-6948 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
北京珐默兹医药科技有限公司15811073878 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
北京新研汇医药研发有限公司13969155946 · [email protected]
Related reactions
10 records
Compound notes
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