3- (2-Fluorophenyl) -1H-pyrazole

CAT: 0127-PC9983-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-PC9983-01Size:1 g

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CAS Number

149739-32-2

MDL Number

MFCD00973917

Purity

97%

Smiles

Fc1ccccc1c2cc[nH]n2

Chemical Information

3-(2-Fluorophenyl)-1H-pyrazole

CAS Number	149739-32-2
PubChem CID	2774734
IUPAC Name	5-(2-fluorophenyl)-1H-pyrazole
Molecular Formula	C9H7FN2
Molecular Weight	162.16
XLogP	2
Topological Polar Surface Area	28.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	12
Formal Charge	0
Complexity	151

SMILES

C1=CC=C(C(=C1)C2=CC=NN2)F

InChI

InChI=1S/C9H7FN2/c10-8-4-2-1-3-7(8)9-5-6-11-12-9/h1-6H,(H,11,12)

InChIKey

PZNGOFHHOGORBU-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 149739-32-2

CID: 2774734

Formula: C9H7FN2

MW: 162.16

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	162.16
XLogP3	2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	162.05932639
Monoisotopic Mass	162.05932639
Topological Polar Surface Area	28.7 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	151
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
PC100665-01	4- (3-Fluorophenyl) -1H-pyrazole
PC3297-01	3- (4-Fluorophenyl) -1H-pyrazole
PC101009-01	4- (2-Fluorophenyl) -1h-pyrazole
PC902185-01	1- (2-Fluorophenyl) -1H-pyrazole
PC1010914-01	3- (2-Fluorophenyl) -5-methyl-1H-pyrazole
PC1023846	3- (4-Bromo-2-fluorophenyl) -1H-pyrazole
PC1002725-01	Methyl 1- (2-fluorophenyl) -1H-pyrazole-3-carboxylate
PC1005005-01	5- (3-Fluorophenyl) -1H-pyrazole-3-carbaldehyde
PC8657	3- (3-Fluorophenyl) -1H-pyrazole-4-carboxaldehyde
PC300891-01	3- (3-Chloro-4-fluorophenyl) -1H-pyrazole

Catalog	Name
sc-356591	3- (2-Fluorophenyl) -1H-pyrazole
MRB82870-01	4- (2-Fluorophenyl) -1H-pyrazole
407566-01	1- (2-Fluorophenyl) -1H-pyrazole
sc-225867	3- (4-Fluorophenyl) -1H-pyrazole
WXB14551-01	4- (3-Fluorophenyl) -1H-pyrazole
434480-01	5- (4-Fluorophenyl) -1H-pyrazole
YLC47752-01	3- (4-Bromo-2-fluorophenyl) -1H-pyrazole
430523-01	4-Bromo-1- (2-fluorophenyl) -1H-pyrazole
sc-297057A	1- (2-Fluorophenyl) -1H-pyrazole-4-carbaldehyde
sc-357426	1- (2-Fluorophenyl) -1H-pyrazole-4-carboxaldehyde