methyl 2-chloro-4,5-dimethoxybenzoate

methyl 2-chloro-4,5-dimethoxybenzoate

CAS: 30714-88-6

Formula: C10H11ClO4

SMILES: COC(=O)C1=CC(OC)=C(OC)C=C1Cl

IUPAC: methyl 2-chloro-4,5-dimethoxybenzoate

InChI: InChI=1S/C10H11ClO4/c1-13-8-4-6(10(12)15-3)7(11)5-9(8)14-2/h4-5H,1-3H3

Composition: C (52.08%), H (4.81%), Cl (15.37%), O (27.75%)

Molar Mass: 230.64

Atom Count: 26

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	230.0345865
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	MILQCPLGDKGVOQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	55.81
Topological Polar Surface Area	44.76
Polarizability	21.76
Ring Count	1
Rotatable Bond Count	4

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