N-Acetyl-L-Homocysteine

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Properties Simple | Detailed

Formula C6H11NO3S
IUPAC Name (2s)-2-acetamido-4-sulfanyl-butanoic acid
Molecular Mass 177.221 g·mol−1
Heat of Formation -616.2 ± 16.7 kJ·mol−1
Dipole Moment 4.30 ± 1.08 D
Volume 211.33 Å 3
Surface Area 206.39 Å 2
HOMO Energy -9.07 ± 0.55 eV
LUMO Energy -0.74 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-acetamido-4-mercapto-butyric acid
  • (2s)-2-acetamido-4-mercaptobutanoic acid
  • (2s)-2-acetamido-4-sulfanyl-butanoic acid
  • (2s)-2-acetamido-4-sulfanylbutanoic acid
  • acetyl-homocysteine
  • l-homocysteine, n-acetyl-
  • n-acetylhomocysteine
CAS Number(s)
  • 7378-21-4
InChIKey REYLLNRLWCBKCM-YFKPBYRVSA-N
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