3-Chloro-4-methylbenzoic acid
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3-Chloro-4-methylbenzoic acid
structure -
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CAS No:
5162-82-3
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Formula:
C8H7ClO2
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Chemical Name:
3-Chloro-4-methylbenzoic acid
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Synonyms:
Benzoic acid,3-chloro-4-methyl-;p-Toluic acid,3-chloro-;3-Chloro-4-methylbenzoic acid;3-Chloro-p-toluic acid
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CAS No:
Characteristics
37.3
3.1
white or yellowish powder
1.3±0.1 g/cm3
196 °C
105-107 °C @ Press: 6.5 Torr
138.0±22.3 °C
1.573
Safety Information
R36/37/38
S26-S37/39
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 7 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:170.59
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:170.0134572
Monoisotopic Mass:170.0134572
Topological Polar Surface Area:37.3
Heavy Atom Count:11
Complexity:158
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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