1- (2-Hydroxyethyl) -1H-pyrazol-4-ol

CAT: 0926-QSB60874-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0926-QSB60874-01Size:1 g

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CAS Number

1065608-74-3

MDL Number

MFCD22071404

Molecular Formula

C5H8N2O2

Molecular Weight

128.13 g/mol

Controlled

Chemical Information

1-(2-hydroxyethyl)-1H-pyrazol-4-ol

CAS Number	1065608-74-3
PubChem CID	67486723
IUPAC Name	1-(2-hydroxyethyl)pyrazol-4-ol
Molecular Formula	C5H8N2O2
Molecular Weight	128.13
XLogP	-0.9
Topological Polar Surface Area	58.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	9
Formal Charge	0
Complexity	89

SMILES

C1=C(C=NN1CCO)O

InChI

InChI=1S/C5H8N2O2/c8-2-1-7-4-5(9)3-6-7/h3-4,8-9H,1-2H2

InChIKey

FOWBHYRWDKNGML-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1065608-74-3

CID: 67486723

Formula: C5H8N2O2

MW: 128.13

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	128.13
XLogP3	-0.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	128.058577502
Monoisotopic Mass	128.058577502
Topological Polar Surface Area	58.3 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	89
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
FP135222-01	1H-Pyrazol-4-ol
VNC74371-01	1- (2-Phenylethyl) -1H-pyrazol-4-ol
UAD20507-01	1- (2-Methoxyphenyl) -1H-pyrazol-4-ol
ADA70284-01	1-isopropyl-1H-pyrazol-4-ol
XNC87636-01	1- (Cyclopropylmethyl) -1H-pyrazol-4-ol
BJA98935-01	1-benzyl-1H-pyrazol-4-ol
BAA07660-01	1-Phenyl-1H-pyrazol-4-ol
YNC93656-01	1- (2,2,2-Trifluoroethyl) -1H-pyrazol-4-ol
CDA45836-01	1- (4-Methoxyphenyl) -1H-pyrazol-4-ol
YAA58556-01	2- (1H-Pyrazol-4-yl) propan-2-ol

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