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2-[(4-Methylbenzyl)oxy]benzaldehyde

HCID 693304
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
85825-85-0
Standard SMILES
Cc1ccc(COc2ccccc2C=O)cc1
InChIKey
KLZXAPCLPREJOL-UHFFFAOYSA-N
Molecular formula
C15H14O2
Average molar mass
226.27 g/mol
Monoisotopic mass
226.09937969

Names & identifiers

Preferred name
2-[(4-Methylbenzyl)oxy]benzaldehyde
IUPAC
2-[(4-methylphenyl)methoxy]benzaldehyde
English name
2-[(4-Methylbenzyl)oxy]benzaldehyde
Molecular formula
C15H14O2
Molecular weight
226.27

Names & synonyms

2-[(4-methylbenzyl)oxy]benzaldehyde85825-85-02-[(4-methylphenyl)methoxy]benzaldehyde2-((4-Methylbenzyl)oxy)benzaldehydeMFCD00564769Cambridge id 52239992-(p-tolylmethoxy)benzaldehydeSCHEMBL9691233DTXSID90351215KLZXAPCLPREJOL-UHFFFAOYSA-N2-(4-methylbenzyloxy)-benzaldehydeALBB-001211
Show more names
Benzaldehyde, 2-[(4-methylphenyl)methoxy]-2-[(4-methylbenzyl)oxy]benzaldehyde(SALTDATA: FREE)
BBL013989SBB016208STK198760AKOS000249485NS-02846CS-0313852ST50207817H21318

Database identifiers

CAS
85825-85-0
PubChem CID
693304
DTXSID
DTXSID90351215

Properties

Computed structural properties

XLogP
3.6
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
231

Chemistry & industry

Suppliers6 total

安徽合诺生物科技有限公司18455579438
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]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
江苏艾康生物医药研发有限公司17714375163 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]

Related reactions

2 records
New reaction record
HRID 371419 reaction equation
HRID 371419As reactantuspto-grants-1985_07
HRID 1541582 reaction equation
HRID 1541582As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

Compound notes

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