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Home > Encyclopedia > H-D-His-OMe2HCl

H-D-His-OMe2HCl

H-D-His-OMe2HCl structure

H-D-His-OMe2HCl 

structure
  • CAS No:

    4467-54-3

  • Formula:

    C7H12ClN3O2

  • Chemical Name:

    H-D-His-OMe2HCl

  • Synonyms:

    REFDUPL:H-D-His-OMe2HCl;D-HistidineMethylEsterHCl;MethylD-histidinatedihydrochloride;(R)-methyl2-amino-3-(1H-imidazol-4-yl)propanoatedihydrochloride

  • Categories:

    Biochemical Engineering  >  Amino Acids and Derivatives

H-D-His-OMe2HCl Basic Attributes

205.64208

241.038483

DTXSID40505928

2933290090

Characteristics

81.00000

0.95480

Off-white to white Solid

197 °C

415.4ºC at 760 mmHg

205ºC

-9.0 ° (C=2, H2O)

Safety Information

UN 3261

14-34-36/37/38

26-36/37/39-43-45-60-37

C

P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, P362

H315

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|Aggregated GHS information provided by 158 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:242.10
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:241.0384821
Monoisotopic Mass:241.0384821
Topological Polar Surface Area:81
Heavy Atom Count:14
Complexity:163
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes

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