3-Fluoro-4-(hydroxymethyl)pyridine - CAS 870063-60-8

Catalog:	BB038167
Product Name:	3-Fluoro-4-(hydroxymethyl)pyridine
CAS:	870063-60-8
Synonyms:	(3-fluoro-4-pyridinyl)methanol; (3-fluoropyridin-4-yl)methanol

Technical Data

Patents

Computed Properties

IUPAC Name:	(3-fluoropyridin-4-yl)methanol
Description:	3-Fluoro-4-(hydroxymethyl)pyridine (CAS# 870063-60-8) is a useful research chemical.
Molecular Weight:	127.12
Molecular Formula:	C6H6FNO
Canonical SMILES:	C1=CN=CC(=C1CO)F
InChI:	InChI=1S/C6H6FNO/c7-6-3-8-2-1-5(6)4-9/h1-3,9H,4H2
InChI Key:	DEGCNYCNQMSEKG-UHFFFAOYSA-N
Boiling Point:	220.969 °C at 760 mmHg
Density:	1.263 g/cm³
MDL:	MFCD11656367
LogP:	0.71300

Publication Number	Title	Priority Date
WO-2021032148-A1	Aminopyrazine compounds as hpk1 inhibitor and the use thereof	20190821
AU-2018336171-A1	Heterocyclic compounds as PAD inhibitors	20170922
CA-3073656-A1	Heterocyclic compounds as pad inhibitors	20170922
CN-111108105-A	Heterocyclic compounds as PAD inhibitors	20170922
IL-273428-D0	Heterocyclic compounds as pad inhibitors	20170922

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Related Functional Groups

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Complexity:	89.1
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	127.043341977
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	127.043341977
Rotatable Bond Count:	1
Topological Polar Surface Area:	33.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.1