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1,2-dichloro-4-(3-ethynylphenoxymethyl)benzene

1,2-dichloro-4-(3-ethynylphenoxymethyl)benzene

Formula: C15H10Cl2O

SMILES: ClC1=C(Cl)C=C(COC2=CC(=CC=C2)C#C)C=C1

IUPAC: 1,2-dichloro-4-[(3-ethynylphenoxy)methyl]benzene

InChI: InChI=1S/C15H10Cl2O/c1-2-11-4-3-5-13(8-11)18-10-12-6-7-14(16)15(17)9-12/h1,3-9H,10H2

Composition: C (65.01%), H (3.64%), Cl (25.58%), O (5.77%)

Molar Mass: 277.14

Atom Count: 28

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 276.0108703
Formal Charge 0
FSP3 0.07
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey XKZXCJRMZBWYRN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 71.92
Topological Polar Surface Area 9.23
Polarizability 28.77
Ring Count 2
Rotatable Bond Count 3

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Struchem co.,ltd
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Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C15H10Cl2O $1,001.00-$1,700.00$1,001.00$1,700.00
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