chempirical

D-(-)-2-Amino-2-phenylacetyl chloride hydrochloride

C8H9Cl2NOCAS 39878-87-0206.07 g/mol

Open in Covalent MOL file
HClH2NOCl
Acyl halidePrimary amine

Properties

Molecular formula
C8H9Cl2NO
Molar mass
206.07 g/mol
Exact mass
205.0061 Da
logP
1.87Crippen estimate
Polar surface area
43.1 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
2
Stereocentres
Rin SMILES atom order

Identifiers

CAS number
39878-87-0
SMILES
Cl.N[C@@H](C(=O)Cl)c1ccccc1
InChIKey
GVVFCAFBYHYGEE-OGFXRTJISA-N
InChI
InChI=1S/C8H8ClNO.ClH/c9-8(11)7(10)6-4-2-1-3-5-6;/h1-5,7H,10H2;1H/t7-;/m1./s1

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Names and synonyms

15 names · show all
  • Benzeneacetyl chloride, α-amino-, hydrochloride (1:1), (αR)-
  • Benzeneacetyl chloride, α-amino-, hydrochloride, (R)-
  • Benzeneacetyl chloride, α-amino-, hydrochloride, (αR)-
  • D-(-)-Phenylglycyl chloride hydrochloride
  • D-(-)-α-Phenylglycyl chloride hydrochloride
  • D-(-)-2-Phenylglycyl chloride hydrochloride
  • D-(-)-α-Aminophenylacetyl chloride hydrochloride
  • D-Phenylglycine chloride hydrochloride
  • D-Phenylglycyl chloride hydrochloride
  • D-(-)-α-Aminophenylacetic acid chloride hydrochloride
  • D-2-Phenylglycyl chloride hydrochloride
  • D-(-)-Phenylglycine chloride hydrochloride
  • (-)-Phenylglycyl chloride hydrochloride
  • (R)-(-)-2-Phenylglycine chloride hydrochloride
  • (R)-2-Amino-2-phenylacetyl chloride hydrochloride

Work with D-(-)-2-Amino-2-phenylacetyl chloride hydrochloride

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

Similar compounds

Diphenylacetyl chloride1871-76-755 % similar D-Phenylglycine methyl ester hydrochloride19883-41-154 % similar α-Chlorobenzeneacetyl chloride2912-62-153 % similar Ethyl D-phenylglycinate hydrochloride17609-48-250 % similar L-Phenylglycine2935-35-550 % similar Dl-phenylglycine69-91-050 % similar (-)-Phenylglycine875-74-150 % similar O-Formyl-D-mandeloyl chloride29169-64-049 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

α-Amino-p-chloroacetophenone hydrochloride5467-71-0

Elsewhere

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