3-(carboxymethylsulfanyl)-3-(1H-imidazol-5-yl)propanoic acid
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3-(carboxymethylsulfanyl)-3-(1H-imidazol-5-yl)propanoic acid
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CAS No:
116208-78-7
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Formula:
C8H10N2O4S
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Chemical Name:
3-(carboxymethylsulfanyl)-3-(1H-imidazol-5-yl)propanoic acid
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Synonyms:
3-((carboxymethyl)thio)-3-(1H-imidazol-4-yl)propanoic acid;3-CMTHPA;116208-78-7;3-((Carboxymethyl)thio)-3-(1H-imidazol-4-yl)propanoic acid;3-Cmthpa;3-[(carboxymethyl)thio]-3-(1h-imidazol-4-yl)propanoic acid;DTXSID70921970;4-(1H-Imidazole-4-yl)-3-thiahexanedioic acid;3-[(carboxymethyl)sulfanyl]-3-(1H-imidazol-5-yl)propanoic acid
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CAS No:
3-(carboxymethylsulfanyl)-3-(1H-imidazol-5-yl)propanoic acid Basic Attributes
230.24 g/mol
230.03612798 g/mol
Computed Properties
Molecular Weight:230.24
XLogP3:-0.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:230.03612798
Monoisotopic Mass:230.03612798
Topological Polar Surface Area:129
Heavy Atom Count:15
Complexity:249
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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