2-Methoxy-5-methyl-β-phenylbenzenepropanoic acid
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2-Methoxy-5-methyl-β-phenylbenzenepropanoic acid
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CAS No:
109089-77-2
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Formula:
C17H18O3
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Chemical Name:
2-Methoxy-5-methyl-β-phenylbenzenepropanoic acid
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Synonyms:
Benzenepropanoic acid,2-methoxy-5-methyl-β-phenyl-;Hydrocinnamic acid,2-methoxy-5-methyl-β-phenyl-;2-Methoxy-5-methyl-β-phenylbenzenepropanoic acid
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CAS No:
2-Methoxy-5-methyl-β-phenylbenzenepropanoic acid Basic Attributes
270.32300
270.32
600-896-9
DTXSID40392759
2918990090
Characteristics
46.53000
3.61020
white crystalline solid
1.138 g/cm3
136-137 °C
419.1ºC at 760 mmHg
151.4ºC
1.569
8.98E-08mmHg at 25°C
Safety Information
|Warning|H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P272, P280, P302+P352, P305+P351+P338, P321, P332+P313, P333+P313, P337+P313, P362, P363, and P501|Aggregated GHS information provided by 4 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:270.32
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:270.125594432
Monoisotopic Mass:270.125594432
Topological Polar Surface Area:46.5
Heavy Atom Count:20
Complexity:309
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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