100-14-1
Product Name:
4-Nitrobenzyl chloride
Formula:
C7H6ClNO2
Synonyms:
α-Chloro-4-nitrotoluene
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Benzene, 1-(chloromethyl)-4-nitro- is a solid. (EPA, 1998) |
|---|---|
| Color/Form | Plates or needles from alcohol |
| Melting Point | 159.8 °F (EPA, 1998) |
| Solubility | Insoluble (NTP, 1992) |
| Density | 1.5647 (NTP, 1992) - Denser than water; will sink |
| Refractive Index | Index of refraction: 1.5647 at 62 °C |
| Other Experimental Properties | UV: 6794 (Sadtler Research Laboratories Spectral Collection) /Benzyl chloride, 2-nitro/ |
| Chemical Classes | Nitrogen Compounds -> Nitros, Aromatic |
SAFETY INFORMATION
| Signal word | Danger |
|---|---|
| Pictogram(s) |
 Corrosion Corrosives GHS05  Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H302:Acute toxicity,oral H314:Skin corrosion/irritation |
| Precautionary Statement Codes |
P260:Do not breathe dust/fume/gas/mist/vapours/spray. P270:Do not eat, drink or smoke when using this product. P280:Wear protective gloves/protective clothing/eye protection/face protection. P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. P303+P361+P353:IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
COMPUTED DESCRIPTORS
| Molecular Weight | 171.58 g/mol |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 171.0087061 g/mol |
| Monoisotopic Mass | 171.0087061 g/mol |
| Topological Polar Surface Area | 45.8 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 138 |
| 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 |
PRODUCT INTRODUCTION
description
Benzene, 1-(chloromethyl)-4-nitro- is a solid. (EPA, 1998)