ethyl 3-formyl-2,4-dihydroxy-6-methylbenzoate
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ethyl 3-formyl-2,4-dihydroxy-6-methylbenzoate
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CAS No:
39503-14-5
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Formula:
C11H12O5
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Chemical Name:
ethyl 3-formyl-2,4-dihydroxy-6-methylbenzoate
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Synonyms:
haematommate; Ethyl hematommate; Benzoic acid,3-formyl-2,4-dihydroxy-6-methyl-,ethyl ester; ethyl haematommate; 3-formyl-2,4-dihydroxy-6-methyl-benzoic acid ethyl ester; ethyl 2,4-dihydroxy-3-formyl-6-methylbenzoate; ethyl heamatommate;Expand
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CAS No:
ethyl 3-formyl-2,4-dihydroxy-6-methylbenzoate Basic Attributes
224.21000
224.06847348
DTXSID60398112
Characteristics
83.83000
1.39540
1.329g/cm3
314ºC at 760 mmHg
117.3ºC
1.603
144 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards]
Computed Properties
Molecular Weight:224.21
XLogP3:2.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:224.06847348
Monoisotopic Mass:224.06847348
Topological Polar Surface Area:83.8
Heavy Atom Count:16
Complexity:265
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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