1,2,3-trimethoxybenzene

1,2,3-trimethoxybenzene

CAS: 634-36-6

Formula: C9H12O3

SMILES: COC1=CC=CC(OC)=C1OC

IUPAC: 1,2,3-trimethoxybenzene

InChI: InChI=1S/C9H12O3/c1-10-7-5-4-6-8(11-2)9(7)12-3/h4-6H,1-3H3

Composition: C (64.27%), H (7.19%), O (28.54%)

Molar Mass: 168.192

Atom Count: 24

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	168.078644246
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	CRUILBNAQILVHZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	45.45
Topological Polar Surface Area	27.69
Polarizability	17.89
Ring Count	1
Rotatable Bond Count	3

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