3-(4-Chlorobenzoyl)propionic acid
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3-(4-Chlorobenzoyl)propionic acid
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CAS No:
3984-34-7
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Formula:
C10H9ClO3
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Chemical Name:
3-(4-Chlorobenzoyl)propionic acid
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Synonyms:
Benzenebutanoic acid,4-chloro-γ-oxo-;Propionic acid,3-(p-chlorobenzoyl)-;4-Chloro-γ-oxobenzenebutanoic acid;3-(p-Chlorobenzoyl)propionic acid;β-(p-Chlorobenzoyl)propionic acid;β-(4-Chlorobenzoyl)propionic acid;3-(4-Chlorobenzoyl)propionic acid;4-Oxo-4-(4-chlorophenyl)butanoic acid;4-(4-Chlorophenyl)-4-oxobutyric acid;β-(4-Chlorophenyl)propionic acid;NSC 5137;4-(4-Chlorophenyl)-4-oxobutanoic acid;3-(4-Chlorobenzoyl)propanoic acid
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CAS No:
3-(4-Chlorobenzoyl)propionic acid Basic Attributes
212.630
212.63
223-627-3
5137
DTXSID30192902
2918300090
Characteristics
54.37000
1.97
1.3±0.1 g/cm3
131 °C
408.8±25.0 °C at 760 mmHg
201.0±23.2 °C
1.561
Insoluble
Safety Information
NONH for all modes of transport
3
R36/37/38
S24/25
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|H302 (16.67%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 6 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:212.63
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:212.0240218
Monoisotopic Mass:212.0240218
Topological Polar Surface Area:54.4
Heavy Atom Count:14
Complexity:219
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-(4-Chlorobenzoyl)propionic acid
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