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2-[(4-Chlorophenyl)methoxy]benzaldehyde

HCID 693299
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
52803-59-5
Standard SMILES
O=Cc1ccccc1OCc1ccc(Cl)cc1
InChIKey
AKOPNWAGXMASTH-UHFFFAOYSA-N
Molecular formula
C14H11ClO2
Average molar mass
246.69 g/mol
Monoisotopic mass
246.0447573

Names & identifiers

Preferred name
2-[(4-Chlorophenyl)methoxy]benzaldehyde
IUPAC
2-[(4-chlorophenyl)methoxy]benzaldehyde
English name
2-[(4-Chlorobenzyl)oxy]benzaldehyde
Molecular formula
C14H11ClO2
Molecular weight
246.69

Names & synonyms

2-[(4-chlorophenyl)methoxy]benzaldehyde2-((4-chlorophenyl)methoxy)benzaldehydeRefChem:449027823-510-22-[(4-chlorobenzyl)oxy]benzaldehyde52803-59-52-((4-Chlorobenzyl)oxy)benzaldehydeMFCD004429362-(4-chlorobenzyloxy)benzaldehydeSCHEMBL3930988SCHEMBL8371569DTXSID10351212
Show more names
AKOS B014090AURORA 23255ASISCHEM N43147CHEMBRDG-BB 3014090ART-CHEM-BB B014090OTAVA-BB BB7110952583Benzaldehyde, 2-[(4-chlorophenyl)methoxy]-2-[(4-chlorobenzyl)oxy]benzaldehyde(SALTDATA: FREE)
AKOPNWAGXMASTH-UHFFFAOYSA-NALBB-001196BBL015589SBB005027STK200380AKOS000248913VS-04976CS-0116517

Database identifiers

CAS
52803-59-5
PubChem CID
693299
DTXSID
DTXSID10351212
EC Number
823-510-2

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
17
Formal charge
0
Complexity
236

Physicochemical properties

Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
319 · H319-H335-H302-H315
Precautionary statements
264 · P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362
Hazard Codes
Xi
Risk Statements
43 · 43
Safety Statements
36 · 36/37
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.

GHS classification

GHS Classification · 4 items

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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

risk_code
43
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
safety_code
36/37
hazard_class
IRRITANT
Hazard statements
H319-H335-H302-H315
Precautionary statements
P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362

Chemistry & industry

Suppliers6 total

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]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]

Related reactions

4 records
New reaction record
HRID 128909 reaction equation
HRID 128909As productuspto-grants-1995_11
HRID 223981 reaction equation
HRID 223981As reactantImidazopyridines dataset
HRID 1489388 reaction equation
HRID 1489388As productuspto-grants-1997_10
HRID 1542530 reaction equation
HRID 1542530As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

Compound notes

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