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(Q82161546)
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English
3-(Aminomethyl)-1-N-Boc-aniline
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
222.136827816
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₂H₁₈N₂O₂
0 references
canonical SMILES
CC(C)(C)OC(=O)NC1=CC=CC(=C1)CN
0 references
Identifiers
InChI
InChI=1S/C12H18N2O2/c1-12(2,3)16-11(15)14-10-6-4-5-9(7-10)8-13/h4-7H,8,13H2,1-3H3,(H,14,15)
0 references
InChIKey
NXQNEOIMZVWHQW-UHFFFAOYSA-N
0 references
CAS Registry Number
205318-52-1
0 references
PubChem CID
2756481
1 reference
matched by identifier from
InChIKey
InChIKey
NXQNEOIMZVWHQW-UHFFFAOYSA-N
SureChEMBL ID
SCHEMBL165660
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NXQNEOIMZVWHQW-UHFFFAOYSA-N
UniChem compound ID
23457909
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80373385
1 reference
matched by identifier from
InChIKey
InChIKey
NXQNEOIMZVWHQW-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID20324417
0 references
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