5-(2-chloroethylsulfanyl)-5-oxopentanoic acid
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5-(2-chloroethylsulfanyl)-5-oxopentanoic acid
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CAS No:
27981-09-5
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Formula:
C7H11ClO3S
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Chemical Name:
5-(2-chloroethylsulfanyl)-5-oxopentanoic acid
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Synonyms:
27981-09-5;5-[(2-chloroethyl)sulfanyl]-5-oxopentanoic acid;NSC94224;DTXSID90294092;NSC-94224
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CAS No:
5-(2-chloroethylsulfanyl)-5-oxopentanoic acid Basic Attributes
210.68 g/mol
210.0117431 g/mol
94224
DTXSID90294092
Computed Properties
Molecular Weight:210.68
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:210.0117431
Monoisotopic Mass:210.0117431
Topological Polar Surface Area:79.7
Heavy Atom Count:12
Complexity:161
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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