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2-[(dimethylamino)methyl]-4-fluorophenol

2-[(dimethylamino)methyl]-4-fluorophenol

CAS: 46049-91-6

Formula: C9H12FNO

SMILES: CN(C)CC1=C(O)C=CC(F)=C1

IUPAC: 2-[(dimethylamino)methyl]-4-fluorophenol

InChI: InChI=1S/C9H12FNO/c1-11(2)6-7-5-8(10)3-4-9(7)12/h3-5,12H,6H2,1-2H3

Composition: C (63.89%), H (7.15%), F (11.23%), N (8.28%), O (9.46%)

Molar Mass: 169.199

Atom Count: 24

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 169.090292173
Formal Charge 0
FSP3 0.33
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey NEGVGBPSCVOSAI-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 46.8
Topological Polar Surface Area 23.47
Polarizability 17.64
Ring Count 1
Rotatable Bond Count 2

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97% <14 Days 46049-91-6 $94.50-$354.38$94.50$354.38
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