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15O

Summary
Name:1-chloronaphthalene
Formula:C10 H7 Cl
Formal charge:0
Formula weight:162.616 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.011-chloronaphthalene
OpenEye OEToolkits1.7.61-chloranylnaphthalene

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01Clc2cccc1ccccc12
InChIInChI1.03InChI=1S/C10H7Cl/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7H
InChIKeyInChI1.03JTPNRXUCIXHOKM-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.370Clc1cccc2ccccc12
SMILESCACTVS3.370Clc1cccc2ccccc12
SMILES_CANONICALOpenEye OEToolkits1.7.6c1ccc2c(c1)cccc2Cl
SMILESOpenEye OEToolkits1.7.6c1ccc2c(c1)cccc2Cl

222624

PDB entries from 2024-07-17

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