(1-Ethyl-5-fluoro-1H-pyrazol-4-yl)methanol - CAS 1702499-28-2

Catalog:	BB050704
Product Name:	(1-Ethyl-5-fluoro-1H-pyrazol-4-yl)methanol
CAS:	1702499-28-2
Synonyms:	1H-Pyrazole-4-methanol, 1-ethyl-5-fluoro-

Technical Data

Computed Properties

IUPAC Name:	(1-ethyl-5-fluoropyrazol-4-yl)methanol
Molecular Weight:	144.15
Molecular Formula:	C6H9FN2O
Canonical SMILES:	CCN1C(=C(C=N1)CO)F
InChI:	InChI=1S/C6H9FN2O/c1-2-9-6(7)5(4-10)3-8-9/h3,10H,2,4H2,1H3
InChI Key:	KAUYCNWFYRFCNH-UHFFFAOYSA-N
Boiling Point:	252.2±25.0°C at 760 mmHg
Purity:	≥95%
Density:	1.3±0.1 g/cm3

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Fluorinated Building Blocks

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[151585-93-2]
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Pyrazoles

[1158353-54-8]
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[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[62838-59-9]
1-Cyclopentyl-1H-pyrazole
[1250876-38-0]
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Complexity:	112
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	144.06989108
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	144.06989108
Rotatable Bond Count:	2
Topological Polar Surface Area:	38
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.1