pent-1-yn-3-yl 4-nitrobenzoate
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pent-1-yn-3-yl 4-nitrobenzoate
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CAS No:
42969-25-5
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Formula:
C12H11NO4
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Chemical Name:
pent-1-yn-3-yl 4-nitrobenzoate
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Synonyms:
42969-25-5;pent-1-yn-3-yl 4-nitrobenzoate;NSC310177;DTXSID00317029;NSC-310177
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CAS No:
pent-1-yn-3-yl 4-nitrobenzoate Basic Attributes
233.22 g/mol
233.06880783 g/mol
310177
DTXSID00317029
Computed Properties
Molecular Weight:233.22
XLogP3:2.6
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:233.06880783
Monoisotopic Mass:233.06880783
Topological Polar Surface Area:72.1
Heavy Atom Count:17
Complexity:330
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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