3-phenylpropyl 2-(3-nitro-1,2,4-triazol-1-yl)acetate
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3-phenylpropyl 2-(3-nitro-1,2,4-triazol-1-yl)acetate
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CAS No:
488136-37-4
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Formula:
C13H14N4O4
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Chemical Name:
3-phenylpropyl 2-(3-nitro-1,2,4-triazol-1-yl)acetate
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Synonyms:
488136-37-4;ZINC2332786;(3-Nitro-[1,2,4]triazol-1-yl)-acetic acid 3-phenyl-propyl ester;CCG-24845;STL301010;AKOS000672185;MCULE-1155403560;ST50279785;3-phenylpropyl 2-(3-nitro-1,2,4-triazolyl)acetate;Z56869021;3-phenylpropyl (3-nitro-1H-1,2,4-triazol-1-yl)acetate;3-phenylpropyl 2-(3-nitro-1H-1,2,4-triazol-1-yl)acetate
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CAS No:
3-phenylpropyl 2-(3-nitro-1,2,4-triazol-1-yl)acetate Basic Attributes
290.27 g/mol
290.10150494 g/mol
Computed Properties
Molecular Weight:290.27
XLogP3:1.9
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:290.10150494
Monoisotopic Mass:290.10150494
Topological Polar Surface Area:103
Heavy Atom Count:21
Complexity:355
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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