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1-Methyl-L-histidine Structure

1-Methyl-L-histidine

  • Product Name1-Methyl-L-histidine
  • CAS332-80-9
  • CBNumberCB7459351
  • MFC7H11N3O2
  • MW169.18
  • EINECS206-368-0
  • MDL NumberMFCD00005295
  • MOL File332-80-9.mol

Chemical Properties

Melting point: ~240 °C (dec.) (lit.)
Boiling point: 298.47°C (rough estimate)
alpha  -24 º (c=2% in H2O)
Density  1.2509 (rough estimate)
refractive index  1.5950 (estimate)
storage temp.  2-8°C(protect from light)
solubility  Methanol (Slightly), Water (Slightly, Sonicated)
pka 1.69(at 25℃)
form  Solid
color  Off-White to Pale Beige
optical activity [α]20/D 24±1°, c = 2% in H2O
BRN  9727
Stability: Hygroscopic
Major Application peptide synthesis
InChI 1S/C7H11N3O2/c1-10-3-5(9-4-10)2-6(8)7(11)12/h3-4,6H,2,8H2,1H3,(H,11,12)/t6-/m0/s1
InChIKey BRMWTNUJHUMWMS-LURJTMIESA-N
SMILES Cn1cnc(C[C@H](N)C(O)=O)c1
CAS DataBase Reference 332-80-9(CAS DataBase Reference)
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Safety

PPE Eyeshields, Gloves, type N95 (US)
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36-24/25-22
WGK Germany  3
HS Code  2933290090
Storage Class 11 - Combustible Solids

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