2-[(3-Methylbenzo[b]thien-2-yl)carbonyl]benzoic acid
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![2-[(3-Methylbenzo[b]thien-2-yl)carbonyl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/9483dcfed7174c7da1b1df44a073a625.png "2-[(3-Methylbenzo[b]thien-2-yl)carbonyl]benzoic acid")
2-[(3-Methylbenzo[b]thien-2-yl)carbonyl]benzoic acid
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CAS No:
175203-98-2
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Formula:
C17H12O3S
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Chemical Name:
2-[(3-Methylbenzo[b]thien-2-yl)carbonyl]benzoic acid
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Synonyms:
Benzoic acid,2-[(3-methylbenzo[b]thien-2-yl)carbonyl]-;2-[(3-Methylbenzo[b]thien-2-yl)carbonyl]benzoic acid;2-(3-Methylbenzo[b]thiophene-2-carbonyl)benzoic acid;2-(3-Methyl-1-benzothiophene-2-carbonyl)benzoic acid;2-[(3-Methylbenzo[b]thiophen-2-yl)carbonyl]benzoic acid
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CAS No:
2-[(3-Methylbenzo[b]thien-2-yl)carbonyl]benzoic acid Basic Attributes
296.34000
296.34
DTXSID20381585
2934999090
Characteristics
82.61000
4.13890
1.347g/cm3
181ºC
511.5ºC at 760 mmHg
263.1ºC
1.689
2.75E-11mmHg at 25°C
Computed Properties
Molecular Weight:296.3
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:296.05071541
Monoisotopic Mass:296.05071541
Topological Polar Surface Area:82.6
Heavy Atom Count:21
Complexity:422
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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