4-([(1-BUTYL-3-CYANO-4,5-DIPHENYL-1H-PYRROL-2-YL)IMINO]METHYL)BENZENECARBOXYLIC ACID
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![4-([(1-BUTYL-3-CYANO-4,5-DIPHENYL-1H-PYRROL-2-YL)IMINO]METHYL)BENZENECARBOXYLIC ACID structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/97274a2d72984ae1824051eebf2bedc7.png "4-([(1-BUTYL-3-CYANO-4,5-DIPHENYL-1H-PYRROL-2-YL)IMINO]METHYL)BENZENECARBOXYLIC ACID")
4-([(1-BUTYL-3-CYANO-4,5-DIPHENYL-1H-PYRROL-2-YL)IMINO]METHYL)BENZENECARBOXYLIC ACID
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CAS No:
478032-86-9
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Formula:
C29H25N3O2
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Chemical Name:
4-([(1-BUTYL-3-CYANO-4,5-DIPHENYL-1H-PYRROL-2-YL)IMINO]METHYL)BENZENECARBOXYLIC ACID
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Synonyms:
4-[(1E)-[(1-butyl-3-cyano-4,5-diphenyl-1H-pyrrol-2-yl)imino]methyl]benzoic acid;4-{[(1-butyl-3-cyano-4,5-diphenyl-1H-pyrrol-2-yl)imino]methyl}benzenecarboxylic acid;AKOS005088966;3P-332S
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CAS No:
4-([(1-BUTYL-3-CYANO-4,5-DIPHENYL-1H-PYRROL-2-YL)IMINO]METHYL)BENZENECARBOXYLIC ACID Basic Attributes
447.53
447.194677
Computed Properties
Molecular Weight:447.5
XLogP3:6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:447.19467705
Monoisotopic Mass:447.19467705
Topological Polar Surface Area:78.4
Heavy Atom Count:34
Complexity:723
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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