Basic information
- CAS
886508-80-1- Standard SMILES
O=Cc1ccc(-c2ccccc2F)s1- InChIKey
OOEYZMUCJTYAFJ-UHFFFAOYSA-N- Molecular formula
- C11H7FOS
- Average molar mass
- 206.24 g/mol
- Monoisotopic mass
- 206.02016418
Names & identifiers
- Preferred name
- 5-(2-Fluorophenyl)thiophene-2-carbaldehyde
- IUPAC
- 5-(2-fluorophenyl)thiophene-2-carbaldehyde
- English name
- 5-(2-Fluoro-phenyl)-thiophene-2-carbaldehyde
- Molecular formula
- C11H7FOS
- Molecular weight
- 206.24
Names & synonyms
5-(2-fluorophenyl)thiophene-2-carbaldehyde886508-80-1RefChem:529518860-618-95-(2-fluorophenyl)-2-thiophenecarbaldehydeMFCD064101795-(2-Fluoro-phenyl)-thiophene-2-carbaldehyde5-(2-fluorophenyl)-2-thiophenecarboxaldehydeSCHEMBL13221493AC7112AKOS004118869AB24047
Show more names
AKOS BAR-14532-Thiophenecarboxaldehyde, 5-(2-fluorophenyl)-
DA-16928SY016267CS-0244888EN300-29625AB00798250-01A1-136738Z2353627815-(2-fluoro-phenyl)-thiophene-2-carbaldehyde, AldrichCPR
Database identifiers
- CAS
886508-80-1- PubChem CID
- 7183203
- EC Number
- 860-618-9
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 45.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 209
Physicochemical properties
- Boiling point
- 331.1 · 331.1±32.0 °C(Predicted)
- Density
- 1.288 · 1.288±0.06 g/cm3(Predicted)
- form
- solid
- InChI
- 1S/C11H7FOS/c12-10-4-2-1-3-9(10)11-6-5-8(7-13)14-11/h1-7H
- InChIKey
- OOEYZMUCJTYAFJ-UHFFFAOYSA-N
- SMILES
- Fc1ccccc1-c2ccc(C=O)s2
- UNSPSC Code
- 12352200 · 12352200
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H315-H302-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22-36
- WGK Germany
- 3 · WGK 3
- HS Code
- 2934999090 · 2934999090
- Storage Class
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)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- wgk
- WGK 3
- hs_code
- 2934999090
- risk_code
- 22-36
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H335-H315-H302-H319
- Hazard Classifications
- Acute Tox. 4 OralEye Irrit. 2
- 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
Suppliers5 total
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
常州探索化学有限公司15295164949 · [email protected]
常州探索化学有限公司+8615295164949 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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