4-Fluoro (1H) indazole

CAT: 0926-FF52045-01Size: 10 gDry Ice: NoHazardous: No

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CAT#:0926-FF52045-01Size:10 g

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CAS Number

341-23-1

Synonyms

4-Fluoroindazole

MDL Number

MFCD07371561

Smiles

C1=CC2=C (C=NN2) C (=C1) F

Molecular Formula

C7H5FN2

Molecular Weight

136.13 g/mol

Controlled

Chemical Information

4-Fluoroindazole

CAS Number	341-23-1
PubChem CID	22477757
IUPAC Name	4-fluoro-1H-indazole
Molecular Formula	C7H5FN2
Molecular Weight	136.13
XLogP	1.7
Topological Polar Surface Area	28.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	10
Formal Charge	0
Complexity	129

SMILES

C1=CC2=C(C=NN2)C(=C1)F

InChI

InChI=1S/C7H5FN2/c8-6-2-1-3-7-5(6)4-9-10-7/h1-4H,(H,9,10)

InChIKey

YTNDJUBXSVSRQK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 341-23-1

CID: 22477757

Formula: C7H5FN2

MW: 136.13

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	136.13
XLogP3	1.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	136.04367633
Monoisotopic Mass	136.04367633
Topological Polar Surface Area	28.7 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	129
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
LXB33492-01	7-Fluoro-1H-indazole-4-carbaldehyde
MKB56913-01	4-Fluoro-6-methoxy-1H-indazole
LXB33463-01	4-Bromo-7-fluoro-1H-indazole
ETB99319-01	Methyl 7-fluoro-1H-indazole-4-carboxylate
IWC61900-01	7-Fluoro-1H-indazole-4-carboxylic acid
YIB67861-01	5-Fluoro-1H-indazole-4-carboxylic acid
HTB04146-01	4-Fluoro-3-iodo-1H-indazole-6-carbonitrile
AJB36408	4- (Benzyloxy) -1H-indazole
LTB39216-01	1H-Indazole-4-carbohydrazide
AQB33998	4- (Trifluoromethyl) -1H-indazole