Basic information
- Standard SMILES
O=Cc1ccc(OCc2c(F)cccc2Cl)cc1- InChIKey
WOUZCDNRKXWPDY-UHFFFAOYSA-N- Molecular formula
- C14H10ClFO2
- Average molar mass
- 264.68 g/mol
- Monoisotopic mass
- 264.03533546
Names & identifiers
- Preferred name
- 4-[(2-Chloro-6-fluorophenyl)methoxy]benzaldehyde
- IUPAC
- 4-[(2-chloro-6-fluorophenyl)methoxy]benzaldehyde
- English name
- 4-(2-Chloro-6-fluorobenzyloxy)benzaldehyde
- Molecular formula
- C14H10ClFO2
- Molecular weight
- 264.68
Names & synonyms
4-[(2-chloro-6-fluorophenyl)methoxy]benzaldehydeDTXSID303527814-((2-chloro-6-fluorophenyl)methoxy)benzaldehydeRefChem:517232DTXCID00303846671-992-6172932-10-44-(2-Chloro-6-fluorobenzyloxy)benzaldehyde4-((2-Chloro-6-fluorobenzyl)oxy)benzaldehyde4-[(2-chloro-6-fluorobenzyl)oxy]benzaldehydeMFCD000522274-[(2-chloro-6-fluorobenzyl)oxy]benzenecarbaldehyde
Show more names
ZINC00151813AKOS B014204ART-CHEM-BB B014204OTAVA-BB BB70188019854-(2-Chloro-6-fluorobenzyloxy)benzaldehyde97%4-(2-Chloro-6-fluorobenzyloxy)benzaldehyde 97%
4-[(2-chloro-6-fluoro-phenyl)methoxy]benzaldehyde4-[(2-Chloro-6-fluorobenzyl)oxy] benzenecarbaldehydeSCHEMBL4909005WOUZCDNRKXWPDY-UHFFFAOYSA-NALBB-001319BBL016400SBB016351STK422087
Database identifiers
- CAS
172932-10-4- PubChem CID
- 735467
- DTXSID
DTXSID30352781- EC Number
- 671-992-6
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 267
Physicochemical properties
- Melting point
- 80 · 80-82°C
- Boiling point
- 388.8 · 388.8±32.0 °C(Predicted)
- Density
- 1.31 · 1.310±0.06 g/cm3(Predicted)
- CAS DataBase Reference
- 172932 · 172932-10-4(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 410 · H410-H302
- Precautionary statements
- 273 · P273-P391-P501-P264-P270-P301+P312-P330-P501
- Hazard Codes
- Xi,Xn
- Risk Statements
- 36 · 36/37/38-22
- Safety Statements
- 26 · 26-36-24/25
- HazardClass
- IRRITANT
- HS Code
- 2932990090 · 2932990090
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (97.6%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P273, P301+P317, P330, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 41 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 CategoriesAcute Tox. 4 (97.6%)
Safety data
- hs_code
- 2932990090
- risk_code
- 36/37/38-22
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- hazard_code
- Xi,Xn
- safety_code
- 26-36-24/25
- hazard_class
- IRRITANT
- Hazard statements
- H410-H302
- Precautionary statements
- P273-P391-P501-P264-P270-P301+P312-P330-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers21 total
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
广东方信生物科技有限公司0751-2838688 13376594225 · [email protected]
宝鸡缔都医药化工有限公司029-81145305 17791533577 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13376591640 · [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
天津荣燊化工有限公司18317763565; 18317763565 · [email protected]
郑州康弗辰医药科技有限公司18210788515; 18210788515 · [email protected]
山东利腾生物科技有限公司15020019777 18663721413 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
广东翁江化学试剂有限公司0751-2815688 13927872512 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
济南思考化学有限公司0531-0000 · [email protected]
Capot Chemical Co., Ltd+86 (0) 571 85 58 67 18
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
上海信旗医药科技有限公司+86-21-54098501 · [email protected]
Related reactions
3 records
Linked notes
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