N'-(4-chloro-2-methylphenyl)-N,N-dimethylmethanimidamide

• ChemBase ID: 126501
• Molecular Formular: C10H13ClN2
• Molecular Mass: 196.67662
• Monoisotopic Mass: 196.07672611
• SMILES: Clc1cc(C)c(/N=C/N(C)C)cc1
• Canonical SMILES: CN(/C=N/c1ccc(cc1C)Cl)C
• InChI: InChI=1S/C10H13ClN2/c1-8-6-9(11)4-5-10(8)12-7-13(2)3/h4-7H,1-3H3
• InChIKey: STUSTWKEFDQFFZ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N'-(4-chloro-2-methylphenyl)-N,N-dimethylmethanimidamide
• IUPAC Traditional name: chlordimeform
• Synonyms: N-(4-Chloro-2-methylphenyl)-N′,N′-dimethylformamidine; Chlorodimeform; Chlorophenamidine; Chlordimeform; Chlorphenamidine; Chlorfenamidine; Fundal; Galecron; Chlordimeform; N-(4-氯-2-甲基苯基)-N′,N′-二甲基甲脒; 杀螨脒; 氯苯脒; 杀虫脒

Database IDs

• CAS Number: 6164-98-3
• EC Number: 228-200-5
• MDL Number: MFCD00055257
• Beilstein Number: 9256367
• PubChem SID: 162220834
• PubChem CID: 22544
• Chemspider ID: 10468746
• KEGG ID: C14746
• Unique Ingredient Identifier: GXA8FP6Y9C
• Wikipedia Title: Chlordimeform

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 0.9175386
• LogD (pH = 7.4): 1.1264143
• Log P: 2.6969898
• Molar Refractivity: 58.7584 cm^3
• Polarizability: 21.318016 Å^3
• Polar Surface Area: 15.6 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: 250 mg/L in water
• Apperance: White crystalline solid
• Melting Point: 32 °C; 225-227 °C (hydrochloride)

Safety Information

• RTECS: LQ4375000
• European Hazard Symbols: Nature polluting (N); Harmful (Xn)
• UN Number: 2810
• German water hazard class: 1
• Hazard Class: 6.1
• Packing Group: 3
• Risk Statements: 21/22-40-50/53
• Safety Statements: 22-36/37-60-61
• GHS Pictograms: GHS07; GHS08; GHS09
• GHS Signal Word: Warning
• GHS Hazard statements: H302-H312-H351-H410
• GHS Precautionary statements: P273-P280-P501
• Personal Protective Equipment: Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 2810 6.1/PG 3
• Storage Temperature: 2-8°C

Product Information

• Grade: PESTANAL®, analytical standard
• Empirical Formula (Hill Notation): C10H13ClN2

DETAILS

Sigma Aldrich - 31099

Legal Information
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