methyl 2,4,6-trimethoxybenzoate

methyl 2,4,6-trimethoxybenzoate

CAS: 29723-28-2

Formula: C11H14O5

SMILES: COC(=O)C1=C(OC)C=C(OC)C=C1OC

IUPAC: methyl 2,4,6-trimethoxybenzoate

InChI: InChI=1S/C11H14O5/c1-13-7-5-8(14-2)10(11(12)16-4)9(6-7)15-3/h5-6H,1-4H3

Composition: C (58.40%), H (6.24%), O (35.36%)

Molar Mass: 226.228

Atom Count: 30

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	226.084123551
Formal Charge	0
FSP3	0.36
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	CEARZEQLIHOYSV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.47
Topological Polar Surface Area	53.99
Polarizability	22.37
Ring Count	1
Rotatable Bond Count	5

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