81-20-9
Product Name:
2,6-Dimethyl-1-nitrobenzene
Formula:
C8H9NO2
Synonyms:
2-Nitro-m-xylene
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | 1,3-dimethyl-2-nitrobenzene is a clear yellow liquid. (NTP, 1992) |
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Boiling Point | 437 °F at 744 mmHg (NTP, 1992) |
Melting Point | 57 to 61 °F (NTP, 1992) |
Flash Point | 190 °F (NTP, 1992) |
Solubility | less than 1 mg/mL at 66 °F (NTP, 1992) |
Density | 1.112 at 59 °F (NTP, 1992) - Denser than water; will sink |
Vapor Pressure | 28.4 mmHg at 100 °F (NTP, 1992) |
Kovats Retention Index | 1197.1 1209.8 1173.1 |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Exclamation Mark Irritant GHS07 Environment GHS09 |
GHS Hazard Statements |
H302:Acute toxicity,oral H411:Hazardous to the aquatic environment, long-term hazard |
Precautionary Statement Codes |
P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P270:Do not eat, drink or smoke when using this product. P273:Avoid release to the environment. P391:Collect spillage. Hazardous to the aquatic environment P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. P501:Dispose of contents/container to..… |
COMPUTED DESCRIPTORS
Molecular Weight | 151.16 g/mol |
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XLogP3 | 3 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 0 |
Exact Mass | 151.063328530 g/mol |
Monoisotopic Mass | 151.063328530 g/mol |
Topological Polar Surface Area | 45.8 Ų |
Heavy Atom Count | 11 |
Formal Charge | 0 |
Complexity | 143 |
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
1,3-dimethyl-2-nitrobenzene is a clear yellow liquid. (NTP, 1992)