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2,6-dimethoxybenzamide

2,6-dimethoxybenzamide

CAS: 21864-67-5

Formula: C9H11NO3

SMILES: COC1=CC=CC(OC)=C1C(N)=O

IUPAC: 2,6-dimethoxybenzamide

InChI: InChI=1S/C9H11NO3/c1-12-6-4-3-5-7(13-2)8(6)9(10)11/h3-5H,1-2H3,(H2,10,11)

Composition: C (59.66%), H (6.12%), N (7.73%), O (26.49%)

Molar Mass: 181.191

Atom Count: 24

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 181.073893218
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey ZAUCRONGJXRQRD-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 48.06
Topological Polar Surface Area 61.55
Polarizability 18.23
Ring Count 1
Rotatable Bond Count 3

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