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3-(methoxymethyl)aniline

3-(methoxymethyl)aniline

CAS: 53473-83-9

Formula: C8H11NO

SMILES: COCC1=CC(N)=CC=C1

IUPAC: 3-(methoxymethyl)aniline

InChI: InChI=1S/C8H11NO/c1-10-6-7-3-2-4-8(9)5-7/h2-5H,6,9H2,1H3

Composition: C (70.04%), H (8.08%), N (10.21%), O (11.66%)

Molar Mass: 137.182

Atom Count: 21

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 137.084063978
Formal Charge 0
FSP3 0.25
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey IRMGVBTVFRYBGN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 42.33
Topological Polar Surface Area 35.25
Polarizability 15.84
Ring Count 1
Rotatable Bond Count 2

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