Acetic acid, [(3-chloro-7,8,9,10-tetrahydro-6-phenanthridinyl)thio]-, phenylmethyl ester (9CI)
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Acetic acid, [(3-chloro-7,8,9,10-tetrahydro-6-phenanthridinyl)thio]-, phenylmethyl ester (9CI)
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CAS No:
606108-83-2
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Formula:
C22H20ClNO2S
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Chemical Name:
Acetic acid, [(3-chloro-7,8,9,10-tetrahydro-6-phenanthridinyl)thio]-, phenylmethyl ester (9CI)
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Synonyms:
ZINC4859077;AKOS000685737;MCULE-2522684677;Benzyl [(3-chloro-7,8,9,10-tetrahydro-6-phenanthridinyl)sulfanyl]acetate
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CAS No:
Acetic acid, [(3-chloro-7,8,9,10-tetrahydro-6-phenanthridinyl)thio]-, phenylmethyl ester (9CI) Basic Attributes
397.9177
397.09
Computed Properties
Molecular Weight:397.9
XLogP3:6.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:397.0903277
Monoisotopic Mass:397.0903277
Topological Polar Surface Area:64.5
Heavy Atom Count:27
Complexity:499
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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