H-D-Arg-ome 2hcl

C7H18Cl2N4O2CAS 78851-84-0261.15 g/mol

Open in Covalent MOL file
OONNH2NH2NH2HClHCl
EsterGuanidinePrimary amine

Properties

Molecular formula
C7H18Cl2N4O2
Molar mass
261.15 g/mol
Exact mass
260.0807 Da
logP
-0.62Crippen estimate
Polar surface area
116.7 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
5
Stereocentres
Rin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
78851-84-0
SMILES
COC(=O)[C@@H](CCCN=C(N)N)N.Cl.Cl
InChIKey
XQYZOBNLCUAXLF-ZJIMSODOSA-N
InChI
InChI=1S/C7H16N4O2.2ClH/c1-13-6(12)5(8)3-2-4-11-7(9)10;;/h5H,2-4,8H2,1H3,(H4,9,10,11);2*1H/t5-;;/m1../s1

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Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Arginine methyl ester dihydrochloride26340-89-6

Similar compounds

L-Glutamine methyl ester hydrochloride32668-14-764 % similar D-Glutamine methyl ester hydrochloride74817-54-264 % similar Methyl L-ornithine dihydrochloride40216-82-863 % similar H-D-Arg(no2)-ome hcl50912-92-062 % similar Methyl L-lysinate dihydrochloride26348-70-961 % similar D-Lysine methyl ester dihydrochloride67396-08-161 % similar Nε-tert-Butoxycarbonyllysine methyl ester hydrochloride2389-48-258 % similar (S)-Methyl 2-aminobutanoate hydrochloride56545-22-356 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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