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Basic information
- CAS
1200-15-3- Standard SMILES
OCCOCc1ccc(Cl)cc1- InChIKey
QWKQPDIBDYVUIZ-UHFFFAOYSA-N- Molecular formula
- C9H11ClO2
- Average molar mass
- 186.63 g/mol
- Monoisotopic mass
- 186.0447573
Names & identifiers
- Preferred name
- 2-[(4-Chlorobenzyl)oxy]-1-ethanol
- IUPAC
- 2-[(4-chlorophenyl)methoxy]ethanol
- English name
- 2-[(4-Chlorobenzyl)oxy]-1-ethanol
- Molecular formula
- C9H11ClO2
- Molecular weight
- 186.64
Names & synonyms
1200-15-32-[(4-chlorobenzyl)oxy]-1-ethanol2-[(4-chlorophenyl)methoxy]ethanol2-((4-Chlorobenzyl)oxy)ethanol2-[(4-chlorophenyl)methoxy]ethan-1-olMFCD00172032Ethanol, 2-[(4-chlorophenyl)methoxy]-2-(4-chloro-benzyloxy)-ethanol2-{[(4-chlorophenyl)methyl]oxy}ethanolSCHEMBL1179088DTXSID30377131QWKQPDIBDYVUIZ-UHFFFAOYSA-N
Show more names
SBB0905082-((4-Chlorobenzyl)oxy)ethan-1-olAKOS005070193SB84050DB-041519CS-04538423G-963
Database identifiers
- CAS
1200-15-3- PubChem CID
- 2763751
- DTXSID
DTXSID30377131
Properties
Computed structural propertiesFilling in
- XLogP
- 1.5
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 111
Physicochemical properties
- Melting point
- 108 · 108-112°C
- Boiling point
- 108 · 108-112°/0.3mm
- Density
- 1.1996 g/cm3 · 1.1996 g/cm3
- pka
- 14.35 · 14.35±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- HazardClass
- IRRITANT
- HS Code
- 2909498090 · 2909498090
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
- hs_code
- 2909498090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers5 total
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
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]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
Related reactions
18 records
Compound notes
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