1,4-dimethyl 2,6-dichlorobenzene-1,4-dicarboxylate

1,4-dimethyl 2,6-dichlorobenzene-1,4-dicarboxylate

CAS: 264276-14-4

Formula: C10H8Cl2O4

SMILES: COC(=O)C1=CC(Cl)=C(C(=O)OC)C(Cl)=C1

IUPAC: 1,4-dimethyl 2,6-dichlorobenzene-1,4-dicarboxylate

InChI: InChI=1S/C10H8Cl2O4/c1-15-9(13)5-3-6(11)8(7(12)4-5)10(14)16-2/h3-4H,1-2H3

Composition: C (45.66%), H (3.07%), Cl (26.95%), O (24.33%)

Molar Mass: 263.07

Atom Count: 24

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	261.9799641
Formal Charge	0
FSP3	0.2
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	LOKPWGMXOIYCAH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	59.72
Topological Polar Surface Area	52.6
Polarizability	23.15
Ring Count	1
Rotatable Bond Count	4

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