5-Chloro-3-methyl-1-phenylpyrazole - CAS 1131-17-5

Catalog:	BB003104
Product Name:	5-Chloro-3-methyl-1-phenylpyrazole
CAS:	1131-17-5
Synonyms:	5-chloro-3-methyl-1-phenylpyrazole; 5-chloro-3-methyl-1-phenylpyrazole

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	5-chloro-3-methyl-1-phenylpyrazole
Description:	5-Chloro-3-methyl-1-phenylpyrazole (CAS# 1131-17-5) is a useful research chemical.
Molecular Weight:	192.64
Molecular Formula:	C10H9ClN2
Canonical SMILES:	CC1=NN(C(=C1)Cl)C2=CC=CC=C2
InChI:	InChI=1S/C10H9ClN2/c1-8-7-10(11)13(12-8)9-5-3-2-4-6-9/h2-7H,1H3
InChI Key:	ZZOWFLAMMWOSCG-UHFFFAOYSA-N
Boiling Point:	114 °C (4 torr)
Density:	1.2 g/cm³
MDL:	MFCD00067853
LogP:	2.83410

Publication Number	Title	Priority Date
US-10519172-B2	Complexes for nucleophilic, radical, and electrophilic polyfluoroalkylation	20160623
US-2019127397-A1	Complexes for Nucleophilic, Radical, and Electrophilic Polyfluoroalkylation	20160623
WO-2017223406-A1	Complexes for nucleophilic, radical, and electrophilic polyfluoroalkylation	20160623
CA-2903612-A1	Pyrazole derivatives and their uses thereof	20130313
DK-2970138-T3	PYRAZOLD DERIVATIVES AND THEIR USE THEREOF	20130313

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Related Functional Groups

Pyrazoles

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[1006473-17-1]
[(2,3-Difluorophenyl)methyl][(1,3-dimethylpyrazol-4-yl)methyl]amine
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[333311-69-6]
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[62838-59-9]
1-Cyclopentyl-1H-pyrazole
[1250876-38-0]
1-Cyclopentyl-1H-pyrazole-3,5-diamine

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:	168
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	192.045426
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	192.045426
Rotatable Bond Count:	1
Topological Polar Surface Area:	17.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.3