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(Q82567822)
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English
Methyl 4-(aminomethyl)-3-chlorobenzoate
chemical compound
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
199.04000624
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₉H₁₀ClNO₂
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canonical SMILES
COC(=O)C1=CC(=C(C=C1)CN)Cl
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Identifiers
InChI
InChI=1S/C9H10ClNO2/c1-13-9(12)6-2-3-7(5-11)8(10)4-6/h2-4H,5,11H2,1H3
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InChIKey
VXLLMVXXEXMLNL-UHFFFAOYSA-N
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CAS Registry Number
940062-11-3
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PubChem CID
40151823
1 reference
matched by identifier from
InChIKey
InChIKey
VXLLMVXXEXMLNL-UHFFFAOYSA-N
UniChem compound ID
18910344
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70653926
1 reference
matched by identifier from
InChIKey
InChIKey
VXLLMVXXEXMLNL-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID30604676
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