5-CHLORO-2-NITROCINNAMICACID
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5-CHLORO-2-NITROCINNAMICACID
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CAS No:
20357-28-2
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Formula:
C9H6ClNO4
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Chemical Name:
5-CHLORO-2-NITROCINNAMICACID
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Synonyms:
5-Chloro-2-nitrocinnamic acid;5-CHLORO-2-NITROCINNAMICACID;2-Propenoicacid, 3-(5-chloro-2-nitrophenyl)-;(E)-3-(5-chloro-2-nitrophenyl)prop-2-enoic acid;2-Nitro-5-chlorocinnamic acid;SCHEMBL8126076;ZINC2558076;ZB1750;3-(5-Chloro-2-nitrophenyl)acrylic acid;SC-40976
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CAS No:
Characteristics
83.12000
2.86920
1.529 g/cm3
174-175ºC
417.2ºC at 760 mmHg
206.1ºC
1.663
1.05E-07mmHg at 25°C
Computed Properties
Molecular Weight:227.60
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:226.9985354
Monoisotopic Mass:226.9985354
Topological Polar Surface Area:83.1
Heavy Atom Count:15
Complexity:286
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes