4-Methylsulphonylbenzaldehyde
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4-Methylsulphonylbenzaldehyde
structure -
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CAS No:
5398-77-6
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Formula:
C8H8O3S
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Chemical Name:
4-Methylsulphonylbenzaldehyde
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Synonyms:
4-Mesylbenzaldehyde;TIMTEC-BB SBB005572;4-Methylsulphonyl be;P-MethylsufonylBenzaldehyde;4-(Methylsulfonyl)benaldehyde;Of thiaMphenicol benzaldehyde;4-METHANESULFONYL-BENZALDEHYDE;4-METHYLSULPHONYL BENZALDEHYDE;4-(METHYLSULFONYL)BENZALDEHYDE;p-methylsulphonyl benzaldehyde
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CAS No:
4-Methylsulphonylbenzaldehyde Basic Attributes
184.21
184.019
1312995-182-4
3011
DTXSID00277593
29130000
Characteristics
59.6
-0.1
Light yellow-beige to light brown Crystalline Powder or Crystals
1.3761 (rough estimate)
155-161 °C
288.16°C (rough estimate)
Safety Information
36
24/25-26
Xi
Irritant
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 4 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:184.21
XLogP3:-0.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:184.01941529
Monoisotopic Mass:184.01941529
Topological Polar Surface Area:59.6
Heavy Atom Count:12
Complexity:242
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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