(Z)-3-(2,4-dichlorophenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic acid
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![(Z)-3-(2,4-dichlorophenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/f90565fa669c47f0a5e4fc09b8869a93.png "(Z)-3-(2,4-dichlorophenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic acid")
(Z)-3-(2,4-dichlorophenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic acid
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CAS No:
740814-95-3
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Formula:
C12H9Cl2N3O2S
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Chemical Name:
(Z)-3-(2,4-dichlorophenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic acid
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Synonyms:
ZINC6129873;STL050744;AKOS005703539;AKOS032383602;(2Z)-3-(2,4-dichlorophenyl)-2-[(3-methyl-1H-1,2,4-triazol-4-ium-5-yl)sulfanyl]prop-2-enoate;740814-95-3
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CAS No:
(Z)-3-(2,4-dichlorophenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic acid Basic Attributes
330.2 g/mol
328.9792531 g/mol
Computed Properties
Molecular Weight:330.2
XLogP3:4.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:328.9792531
Monoisotopic Mass:328.9792531
Topological Polar Surface Area:104
Heavy Atom Count:20
Complexity:397
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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