I-BUT-CYS-OH
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I-BUT-CYS-OH
structure -
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CAS No:
124529-02-8
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Formula:
C7H13NO3S
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Chemical Name:
I-BUT-CYS-OH
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Synonyms:
N-isobutyrylcysteine;(R)-N-Isobutyryl-2-(mercaptomethyl)glycine;(2R)-2-(2-methylpropanoylamino)-3-sulfanylpropanoic acid;(2R)-2-(2-methylpropanoylamino)-3-sulfanyl-propanoic acid;(2R)-2-(isobutyrylamino)-3-mercapto-propionic acid;(R)-2-isobutyraMido-3-Mercaptopropanoic acid;N-ISOBUTYRYL-L-CYSTEINE;N-(2-METHYLPROPIONYL)-L-CYSTEINE
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CAS No:
Characteristics
67.4
0.53250
1.199±0.06 g/cm3(Predicted)
97-101 °C
401.6±40.0 °C(Predicted)
196.7ºC
1.507
2-8°C
1.42E-07mmHg at 25°C
Computed Properties
Molecular Weight:191.25
XLogP3:0.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:191.06161445
Monoisotopic Mass:191.06161445
Topological Polar Surface Area:67.4
Heavy Atom Count:12
Complexity:182
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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