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Home >> Chemical Listing >> Page 242 >> N-(Chloroacetyl)-4-(Methylsulfanyl)-D-Isovaline

N-(Chloroacetyl)-4-(Methylsulfanyl)-D-Isovaline
[CAS# 121703-94-4]

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Identification
Name N-(Chloroacetyl)-4-(Methylsulfanyl)-D-Isovaline
Synonyms (R)-2-(2-chloroacetamido)-2-methyl-4-(methylthio)butanoic acid
Molecular Structure CAS#: 121703-94-4, N-(Chloroacetyl)-4-(Methylsulfanyl)-D-Isovaline
Molecular Formula C8H14ClNO3S
Molecular Weight 239.72
CAS Registry Number 121703-94-4
SMILES C[C@@](CCSC)(C(=O)O)NC(=O)CCl
InChI 1S/C8H14ClNO3S/c1-8(7(12)13,3-4-14-2)10-6(11)5-9/h3-5H2,1-2H3,(H,10,11)(H,12,13)/t8-/m1/s1
InChIKey HKEFDCOPTLEAPT-MRVPVSSYSA-N
Properties
Density 1.285g/cm3 (Cal.)
Boiling point 475.239°C at 760 mmHg (Cal.)
Flash point 241.216°C (Cal.)
Refractive index 1.524 (Cal.)
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