Chemical structure of CAS 715-51-5

Phenanthrene, 3-chloro-

CAS No.715-51-5
MDL No.N/A
MFC14H9Cl
MW212.67
InChI KeyBVFJTESUEYBUOL-UHFFFAOYSA-N
CommercialCapacity
CustomizablePurity
ReadyProduction Status
27 Feb 2025Updated
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Identifiers

Canonical SMILESC1=CC=C2C(=C1)C=CC3=C2C=C(C=C3)Cl
Isomeric SMILESC1=CC=C2C(=C1)C=CC3=C2C=C(C=C3)Cl
IUPAC Name3-chlorophenanthrene
InChIInChI=1S/C14H9Cl/c15-12-8-7-11-6-5-10-3-1-2-4-13(10)14(11)9-12/h1-9H
InChI KeyBVFJTESUEYBUOL-UHFFFAOYSA-N

Computational Chemistry

Heavy Atom Count15Rotatable Bond Count0
Atom Stereo Count0Bond Stereo Count0
HBA0HBD0
TPSAN/A ŲCharge0
Exact Mass212.03928Complexity640.96
pKa7.765XLogP4.646

Regulatory Information

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