4-Methoxy-γ-oxobenzenebutanoic acid
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4-Methoxy-γ-oxobenzenebutanoic acid
structure -
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CAS No:
3153-44-4
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Formula:
C11H12O4
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Chemical Name:
4-Methoxy-γ-oxobenzenebutanoic acid
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Synonyms:
Benzenebutanoic acid,4-methoxy-γ-oxo-;Propionic acid,3-p-anisoyl-;4-Methoxy-γ-oxobenzenebutanoic acid;3-p-Anisoylpropionic acid;3-(4-Methoxybenzoyl)propionic acid;3-(p-Methoxybenzoyl)propionic acid;3-(4-Methoxybenzoyl)propanoic acid;4-Oxo-4-(4-methoxyphenyl)butanoic acid;β-(4-Methoxybenzoyl)propionic acid;4-(4-Methoxyphenyl)-4-oxobutyric acid;3-(p-Methoxybenzoyl)propanoic acid;4-(4-Methoxyphenyl)-4-oxobutanoic acid;NSC 12472;4-(4-Methoxybenzoyl)propionic acid
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CAS No:
4-Methoxy-γ-oxobenzenebutanoic acid Basic Attributes
208.21
208.21
221-593-4
12472
DTXSID50185432
2918990090
Characteristics
63.6
1.4
white powder.
1.2±0.1 g/cm3
148-150 °C
419.5°C at 760 mmHg
167.5±16.7 °C
1.536
0.09 M
Safety Information
NONH for all modes of transport
3
R36/37/38
S26-S36
Xi:Irritant;
P261-P305 + P351 + P338
H315-H319-H335
|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 44 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:208.21
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:208.07355886
Monoisotopic Mass:208.07355886
Topological Polar Surface Area:63.6
Heavy Atom Count:15
Complexity:229
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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4-Methoxy-γ-oxobenzenebutanoic acid
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