Search Result : Detailed Informations

Low Mol Weight Allergen Name CAS# CID
Chloroallyl methenamine 4080-31-3 5846454
Structure Other Information
Canonical SMILES C1N2CN3CN1C[N+](C2)(C3)CC=CCl
Iso SMILES C1N2CN3CN1C[N+](C2)(C3)C/C=CCl
InChI InChI=1S/C9H16ClN4/c10-2-1-3-14-7-11-4-12(8-14)6-13(5-11)9-14/h1-2H,3-9H2/q+1/b2-1-
InChI Key LDLCEGCJYSDJLX-UPHRSURJSA-N
Formula C9H16ClN4+
Mol Weight 215.703
XlogP3 1.2
Charge 1

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