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2-chloro-1-(chloromethyl)-3,4-dimethoxybenzene

2-chloro-1-(chloromethyl)-3,4-dimethoxybenzene

CAS: 93983-14-3

Formula: C9H10Cl2O2

SMILES: COC1=CC=C(CCl)C(Cl)=C1OC

IUPAC: 2-chloro-1-(chloromethyl)-3,4-dimethoxybenzene

InChI: InChI=1S/C9H10Cl2O2/c1-12-7-4-3-6(5-10)8(11)9(7)13-2/h3-4H,5H2,1-2H3

Composition: C (48.90%), H (4.56%), Cl (32.07%), O (14.47%)

Molar Mass: 221.08

Atom Count: 23

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 220.005785
Formal Charge 0
FSP3 0.33
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey ZRCXRIHUKHLNFX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 53.66
Topological Polar Surface Area 18.46
Polarizability 20.98
Ring Count 1
Rotatable Bond Count 3

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Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 93983-14-3 $51.35-$884.93$51.35$63.37$86.31$176.99$619.45$884.93
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