DiMethyl5-ethynylisophthalate
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DiMethyl5-ethynylisophthalate
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CAS No:
313648-56-5
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Formula:
C12H10O4
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Chemical Name:
DiMethyl5-ethynylisophthalate
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Synonyms:
DiMethyl 5-ethynylisophthalate;Dimethyl 5-acetylenylphenyl-1,3-dicarboxylate;Dimethyl 5-ethynylbenzene-1,3-dioate;1,3-Benzenedicarboxylic acid, 5-ethynyl-, 1,3-dimethyl ester;Dimethyl 5-ethynylisophthalate 97%
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CAS No:
Computed Properties
Molecular Weight:218.20
XLogP3:1.9
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:218.05790880
Monoisotopic Mass:218.05790880
Topological Polar Surface Area:52.6
Heavy Atom Count:16
Complexity:301
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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