1-(Difluoromethyl)-4-iodo-1H-pyrazole - CAS 1041205-43-9

Catalog:	BB052046
Product Name:	1-(Difluoromethyl)-4-iodo-1H-pyrazole
CAS:	1041205-43-9
Synonyms:	4-Iodo-1-difluoromethylpyrazole

Ordering Information

Catalog	Size	Price	Stock	Quantity
BB052046	5 g	$998	In stock

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Technical Data

Safety and Hazards

Computed Properties

IUPAC Name:	1-(difluoromethyl)-4-iodopyrazole
Molecular Weight:	243.98
Molecular Formula:	C4H3F2IN2
Canonical SMILES:	C1=C(C=NN1C(F)F)I
InChI:	InChI=1S/C4H3F2IN2/c5-4(6)9-2-3(7)1-8-9/h1-2,4H
InChI Key:	VMZIHPOJBPKGDR-UHFFFAOYSA-N
Boiling Point:	215.0±40.0 °C at 760 mmHg
Purity:	>95%
Density:	2.3±0.1 g/cm3
Appearance:	Light Brown Liquid

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Related Functional Groups

Fluorinated Building Blocks

[1106917-71-8]
[3-(Difluoromethoxy)phenyl]methanamine hydrochloride
[479552-94-8]
1H-Pyrrolo[2,3-b]pyridin-4-yl trifluoromethanesulfonate
[1018125-51-3]
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid
[35989-28-7]
2,5-Dichloro-4-fluorobenzoic acid
[1975118-13-8]
4-[3-(Difluoromethyl)-4-methyl-1H-pyrazol-1-yl]aniline
[927800-47-3]
4-Chloro-6-fluoro-2-trichloromethyl-quinoline

Halides

[333311-69-6]
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[2367-82-0]
1,2,3,5-Tetrafluorobenzene
[932890-93-2]
1-{4-[(2,4-Dichlorobenzyl)oxy]-3-ethoxyphenyl}methanamine
[4185-62-0]
2-Bromo-1-nitronaphthalene
[2114-39-8]
2-Bromo-1-phenylpropane
[56517-33-0]
2-Bromo-4-isopropoxy-5-methoxybenzaldehyde

Pyrazoles

[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[333311-69-6]
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[1431970-24-9]
2,2-Difluoro-N-[1-(1-methylpyrazol-4-yl)ethyl]ethanamine hydrochloride
[1005626-64-1]
3-(1,3-Dimethylpyrazol-4-yl)-5-[(1-methylpyrazol-4-yl)methylidene]-2-sulfanylideneimidazolidin-4-one
[514801-07-1]
3-[(4-Chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	101
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	243.9309
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	243.9309
Rotatable Bond Count:	1
Topological Polar Surface Area:	17.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.7