6-BENZYL-5-OXOTHIOMORPHOLINE-3-CARBOXYLIC ACID
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6-BENZYL-5-OXOTHIOMORPHOLINE-3-CARBOXYLIC ACID
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CAS No:
31560-30-2
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Formula:
C12H13NO3S
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Chemical Name:
6-BENZYL-5-OXOTHIOMORPHOLINE-3-CARBOXYLIC ACID
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Synonyms:
6-benzyl-5-oxothiomorpholine-3-carboxylic acid;31560-30-2;CTK7J0720;AKOS005217991;MCULE-4205541189;EN300-26462;Z271099580;6-Benzyl-5-oxothiomorpholine-3-carboxylic acid 31560-30-2
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CAS No:
Computed Properties
Molecular Weight:251.30
XLogP3:1.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:251.06161445
Monoisotopic Mass:251.06161445
Topological Polar Surface Area:91.7
Heavy Atom Count:17
Complexity:302
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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