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1,2,3-trichloro-4-methoxybenzene

1,2,3-trichloro-4-methoxybenzene

CAS: 54135-80-7

Formula: C7H5Cl3O

SMILES: COC1=C(Cl)C(Cl)=C(Cl)C=C1

IUPAC: 1,2,3-trichloro-4-methoxybenzene

InChI: InChI=1S/C7H5Cl3O/c1-11-5-3-2-4(8)6(9)7(5)10/h2-3H,1H3

Composition: C (39.76%), H (2.38%), Cl (50.29%), O (7.57%)

Molar Mass: 211.47

Atom Count: 16

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 209.9405979
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey FRQUNVLMWIYOLV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 46.94
Topological Polar Surface Area 9.23
Polarizability 18.65
Ring Count 1
Rotatable Bond Count 1

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