Basic information
- CAS
177756-62-6- Standard SMILES
Cc1ccc(C=O)cc1F- InChIKey
UFPBMVRONDLOGK-UHFFFAOYSA-N- Molecular formula
- C8H7FO
- Average molar mass
- 138.14 g/mol
- Monoisotopic mass
- 138.04809301
Names & identifiers
- Preferred name
- 3-Fluoro-4-methylbenzaldehyde
- IUPAC
- 3-fluoro-4-methylbenzaldehyde
- English name
- 3-FLUORO-4-METHYLBENZALDEHYDE
- Molecular formula
- C8H7FO
- Molecular weight
- 138.14
Names & synonyms
3-Fluoro-4-methylbenzaldehyde177756-62-6DTXSID80379105RefChem:501784DTXCID40330131626-679-93-fluoro-4-methyl-benzaldehydeBENZALDEHYDE, 3-FLUORO-4-METHYL-MFCD016315323-Fluoro-p-tolualdehydeSCHEMBL229897SCHEMBL1044275
Show more names
2,3,8-Trifluoroacetophenone3-Fluoro-4-methybenzaldehyde3-Fluoro-4-methylbenzaldehyde>3-Fluoro-4-methylbenzaldehyde98%3-Fluoro-4-methylbenzaldehyde 98%Benzaldehyde, 3-fluoro-4-methyl- (9CI)2-Fluoro-4-formyltoluene, 3-Fluoro-p-tolualdehyde
CHEMBL1650251SCHEMBL29453098UFPBMVRONDLOGK-UHFFFAOYSA-NCL8327SBB0860033-Fluoro-4-methylbenzaldehyde, 98%AKOS005258331CS-W018316
Database identifiers
- CAS
177756-62-6- PubChem CID
- 2774574
- DTXSID
DTXSID80379105- ChEMBL
CHEMBL1650251- EC Number
- 626-679-9
- Nikkaji
- J1.302.325E
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 124
Physicochemical properties
- Boiling point
- 206 °C · 206 °C(lit.)
- Density
- 1.133 g/mL · 1.133 g/mL at 25 °C(lit.)
- refractive index
- 20 · n20/D 1.5245(lit.)
- Flash point
- 206 °C · 206°C
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- form
- clear liquid
- color
- Light yellow to Yellow to Orange
- Sensitive
- Air Sensitive
- BRN
- 7699714 · 7699714
- CAS DataBase Reference
- 177756 · 177756-62-6(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335-H227
- Precautionary statements
- 210 · P210-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P403+P235-P501-P261-P305+P351+P338-P210e-P280a-P405-P501a
- Hazard Codes
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
- ridadr
- NA 1993 / PGIII
- hs_code
- 29130000
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36-37
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319-H335-H227
- Precautionary statements
- P210-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P403+P235-P501-P261-P305+P351+P338-P210e-P280a-P405-P501a
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers100 total
常州帝通化工有限公司+86-0519-88298848 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
杭州鸿喜生物医药科技有限公司18989489206 · [email protected]
杭州品高化工有限公司0571-87658025 · [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]
河北枫嘉新材料科技有限公司+86-0311-87836622 +86-18712993135 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
上海辅欣医药科技有限公司+86-021-021-50872116 · [email protected]
Related reactions
37 records
Compound notes
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