3-[4-[(Z)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]-3-(4-fluorophenyl)pyrazol-1-yl]propanoic acid
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![3-[4-[(Z)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]-3-(4-fluorophenyl)pyrazol-1-yl]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/bd87b266834442a5af89fdd5d2088a2f.png "3-[4-[(Z)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]-3-(4-fluorophenyl)pyrazol-1-yl]propanoic acid")
3-[4-[(Z)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]-3-(4-fluorophenyl)pyrazol-1-yl]propanoic acid
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CAS No:
882224-06-8
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Formula:
C18H16FN3O4
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Chemical Name:
3-[4-[(Z)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]-3-(4-fluorophenyl)pyrazol-1-yl]propanoic acid
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Synonyms:
882224-06-8;3-[4-[(Z)-2-cyano-3-ethoxy-3-oxo-prop-1-enyl]-3-(4-fluorophenyl)pyrazol-1-yl]propanoic acid;3-{4-[(1Z)-2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl]-3-(4-fluorophenyl)-1H-pyrazol-1-yl}propanoic acid;CHEMBL2153817;ZINC6179692;AKOS016358874;3-[4-[(Z)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]-3-(4-fluorophenyl)pyrazol-1-yl]propanoic acid;SR-01000010835;SR-01000010835-1;F1218-0515;(Z)-3-(4-(2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl)-3-(4-fluorophenyl)-1H-pyrazol-1-yl)propanoic acid
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CAS No:
3-[4-[(Z)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]-3-(4-fluorophenyl)pyrazol-1-yl]propanoic acid Basic Attributes
357.3 g/mol
357.11248416 g/mol
Computed Properties
Molecular Weight:357.3
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:357.11248416
Monoisotopic Mass:357.11248416
Topological Polar Surface Area:105
Heavy Atom Count:26
Complexity:593
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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