4-[(3-benzyl-4,8-dimethyl-2-oxochromen-7-yl)oxymethyl]benzoic acid
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![4-[(3-benzyl-4,8-dimethyl-2-oxochromen-7-yl)oxymethyl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/f35a29bfee76420a9276946a5b3f5071.png "4-[(3-benzyl-4,8-dimethyl-2-oxochromen-7-yl)oxymethyl]benzoic acid")
4-[(3-benzyl-4,8-dimethyl-2-oxochromen-7-yl)oxymethyl]benzoic acid
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CAS No:
376379-53-2
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Formula:
C26H22O5
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Chemical Name:
4-[(3-benzyl-4,8-dimethyl-2-oxochromen-7-yl)oxymethyl]benzoic acid
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Synonyms:
4-{[(3-benzyl-4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoic acid;4-(((3-BENZYL-4,8-DIMETHYL-2-OXO-2H-CHROMEN-7-YL)OXY)METHYL)BENZOIC ACID;Oprea1_392471;Oprea1_793811;ZINC2118469;STL459611;AKOS001656294;MCULE-4170065370;376379-53-2
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CAS No:
4-[(3-benzyl-4,8-dimethyl-2-oxochromen-7-yl)oxymethyl]benzoic acid Basic Attributes
414.4 g/mol
414.14672380 g/mol
Computed Properties
Molecular Weight:414.4
XLogP3:5.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:414.14672380
Monoisotopic Mass:414.14672380
Topological Polar Surface Area:72.8
Heavy Atom Count:31
Complexity:684
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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