2-ethoxy-4-formylphenyl 2-chloroacetate

2-ethoxy-4-formylphenyl 2-chloroacetate

CAS: 247225-91-8

Formula: C11H11ClO4

SMILES: CCOC1=C(OC(=O)CCl)C=CC(C=O)=C1

IUPAC: 2-ethoxy-4-formylphenyl 2-chloroacetate

InChI: InChI=1S/C11H11ClO4/c1-2-15-10-5-8(7-13)3-4-9(10)16-11(14)6-12/h3-5,7H,2,6H2,1H3

Composition: C (54.45%), H (4.57%), Cl (14.61%), O (26.37%)

Molar Mass: 242.66

Atom Count: 27

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	242.0345865
Formal Charge	0
FSP3	0.27
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	XKYXIOLLSAFYRF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	59.74
Topological Polar Surface Area	52.6
Polarizability	22.92
Ring Count	1
Rotatable Bond Count	6

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