Basic information
- CAS
70205-04-8- Standard SMILES
COc1cc(C=O)ccc1OCc1ccc(Cl)cc1- InChIKey
PNIMHQCVOZNYCG-UHFFFAOYSA-N- Molecular formula
- C15H13ClO3
- Average molar mass
- 276.71 g/mol
- Monoisotopic mass
- 276.055322
Names & identifiers
- Preferred name
- 4-[(4-Chlorophenyl)methoxy]-3-methoxybenzaldehyde
- IUPAC
- 4-[(4-chlorophenyl)methoxy]-3-methoxybenzaldehyde
- English name
- 4-[(4-Chlorobenzyl)oxy]-3-methoxybenzenecarbaldehyde
- Molecular formula
- C15H13ClO3
- Molecular weight
- 276.71
Names & synonyms
70205-04-84-[(4-chlorobenzyl)oxy]-3-methoxybenzaldehyde4-((4-Chlorobenzyl)oxy)-3-methoxybenzaldehyde4-[(4-Chlorobenzyl)Oxy]-3-Methoxybenzenecarbaldehyde4-[(4-chlorophenyl)methoxy]-3-methoxybenzaldehydeMFCD002026924-(4-Chloro-benzyloxy)-3-methoxy-benzaldehyde4-(4-chlorobenzyloxy)-3-methoxybenzaldehydeAURORA 3502Benzaldehyde, 4-[(4-chlorophenyl)methoxy]-3-methoxy-Cambridge id 7151510ASISCHEM N43702
Show more names
OTAVA-BB BB0107930008
Oprea1_281731Oprea1_392456SCHEMBL413085DTXSID50352086ZERENEX E/4047995ALBB-001346AKOS BBS-00008215SALOR-INT L255556-1EA
Database identifiers
- CAS
70205-04-8- PubChem CID
- 718263
- DTXSID
DTXSID50352086- EC Number
- 126-421-0
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 277
Physicochemical properties
- Melting point
- 88 · 88-90°C
- Boiling point
- 419.9 · 419.9±35.0 °C(Predicted)
- Density
- 1.247 · 1.247±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, stored under nitrogen
- Appearance
- White to light yellow Solid
- CAS DataBase Reference
- 70205 · 70205-04-8(CAS DataBase Reference)
- 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.
Safety data
- hazard_code
- Xi
- hazard_class
- IRRITANT
Chemistry & industry
Suppliers10 total
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
陕西麟邦实业有限公司17709134430 · [email protected]
郑州康弗辰医药科技有限公司18210788515; 18210788515 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
华诺医药科技(广西)有限公司13005928603 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
河南阿尔法化工有限公司0371-55055611 18137792234 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
17 records
Compound notes
Loading…