3′-Formyl[1,1′-biphenyl]-4-carboxylic acid
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![3′-Formyl[1,1′-biphenyl]-4-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/5cd8c65124c8457696c8268413372e08.png "3′-Formyl[1,1′-biphenyl]-4-carboxylic acid")
3′-Formyl[1,1′-biphenyl]-4-carboxylic acid
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CAS No:
222180-23-6
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Formula:
C14H10O3
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Chemical Name:
3′-Formyl[1,1′-biphenyl]-4-carboxylic acid
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Synonyms:
[1,1′-Biphenyl]-4-carboxylic acid,3′-formyl-;3′-Formyl[1,1′-biphenyl]-4-carboxylic acid;3′-Formylbiphenyl-4-carboxylic acid
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CAS No:
3′-Formyl[1,1′-biphenyl]-4-carboxylic acid Basic Attributes
226.22700
226.23
DTXSID50383350
2918300090
Characteristics
54.37000
2.86430
1.264g/cm3
231ºC
441.9ºC at 760 mmHg
235.2ºC
1.64
1.37E-08mmHg at 25°C
Safety Information
Xi
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:226.23
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:226.062994177
Monoisotopic Mass:226.062994177
Topological Polar Surface Area:54.4
Heavy Atom Count:17
Complexity:279
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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