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(4-fluoro-1-benzothiophen-2-yl)methanol

(4-fluoro-1-benzothiophen-2-yl)methanol

CAS: 957059-61-9

Formula: C9H7FOS

SMILES: OCC1=CC2=C(F)C=CC=C2S1

IUPAC: (4-fluoro-1-benzothiophen-2-yl)methanol

InChI: InChI=1S/C9H7FOS/c10-8-2-1-3-9-7(8)4-6(5-11)12-9/h1-4,11H,5H2

Composition: C (59.33%), H (3.87%), F (10.43%), O (8.78%), S (17.59%)

Molar Mass: 182.21

Atom Count: 19

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 182.020164182
Formal Charge 0
FSP3 0.11
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey VRHVHHZXYVVURV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 46.21
Topological Polar Surface Area 20.23
Polarizability 18.61
Ring Count 2
Rotatable Bond Count 1

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