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9-chloromethylanthracene

9-chloromethylanthracene

CAS: 24463-19-2

Formula: C15H11Cl

SMILES: ClCC1=C2C=CC=CC2=CC2=CC=CC=C12

IUPAC: 9-(chloromethyl)anthracene

InChI: InChI=1S/C15H11Cl/c16-10-15-13-7-3-1-5-11(13)9-12-6-2-4-8-14(12)15/h1-9H,10H2

Composition: C (79.47%), H (4.89%), Cl (15.64%)

Molar Mass: 226.7

Atom Count: 27

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 226.0549281
Formal Charge 0
FSP3 0.07
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey PCVRSXXPGXRVEZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 68.83
Topological Polar Surface Area 0
Polarizability 29.2
Ring Count 3
Rotatable Bond Count 1

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