CHEMBRDG-BB 6919907
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CHEMBRDG-BB 6919907
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CAS No:
350030-47-6
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Formula:
C13H13NO4S
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Chemical Name:
CHEMBRDG-BB 6919907
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Synonyms:
CHEMBRDG-BB 6919907;2-[(1-ETHYL-2,5-DIOXOPYRROLIDIN-3-YL)THIO]BENZOIC ACID;2-[(1-ethyl-2,5-dioxopyrrolidin-3-yl)thio]benzoic acid(SALTDATA: FREE);2-[(1-Ethyl-2,5-dioxo-3-pyrrolidinyl)sulfanyl]benzoic acid
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CAS No:
Computed Properties
Molecular Weight:279.31
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:279.05652907
Monoisotopic Mass:279.05652907
Topological Polar Surface Area:100
Heavy Atom Count:19
Complexity:398
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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