Methyl 3-(1,1-dimethylethyl)-4-hydroxy-5-methylbenzenepropanoate
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Methyl 3-(1,1-dimethylethyl)-4-hydroxy-5-methylbenzenepropanoate
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CAS No:
6386-39-6
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Formula:
C15H22O3
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Chemical Name:
Methyl 3-(1,1-dimethylethyl)-4-hydroxy-5-methylbenzenepropanoate
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Synonyms:
Benzenepropanoic acid,3-(1,1-dimethylethyl)-4-hydroxy-5-methyl-,methyl ester;Hydrocinnamic acid,3-tert-butyl-4-hydroxy-5-methyl-,methyl ester;Methyl 3-(1,1-dimethylethyl)-4-hydroxy-5-methylbenzenepropanoate;Methyl 3-(3-methyl-5-tert-butyl-4-hydroxyphenyl)propionate;Methyl 3-(3-tert-butyl-4-hydroxy-5-methylphenyl)propionate;Methyl β-(3-tert-butyl-4-hydroxy-5-methylphenyl)propionate;Methyl β-(3-tert-butyl-4-hydroxy-5-methylphenyl)propanoate;Methyl β-(3-(tert-butyl)-5-methyl-4-hydroxyphenyl)propionate;Methyl β-(5-tert-butyl-4-hydroxy-3-methylphenyl)propionate
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CAS No:
Methyl 3-(1,1-dimethylethyl)-4-hydroxy-5-methylbenzenepropanoate Basic Attributes
250.33300
250.15700
DTXSID5073371
2918290000
Safety Information
R22; R51/53
36-61
Xn; N
P264, P270, P273, P301+P312, P330, P391, P501
H302
|Warning|H302: Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P273, P301+P312, P330, P391, and P501|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P273, P301+P312, P304+P340, P312, P330, P391, P403+P233, P405, and P501|Aggregated GHS information provided by 35 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:250.33
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:250.15689456
Monoisotopic Mass:250.15689456
Topological Polar Surface Area:46.5
Heavy Atom Count:18
Complexity:280
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Methyl 3-(1,1-dimethylethyl)-4-hydroxy-5-methylbenzenepropanoate
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