2-Methyl-1-nitronaphthalene

HCID 13432

Basic information

CAS
881-03-8
Standard SMILES
Cc1ccc2ccccc2c1[N+](=O)[O-]
InChIKey
IZNWACYOILBFEG-UHFFFAOYSA-N
Molecular formula
C11H9NO2
Average molar mass
187.19 g/mol
Monoisotopic mass
187.06332853

Overview

1-nitro-2-methylnaphthalene is a yellow solid. (NTP, 1992)

Names & identifiers

Preferred name
2-Methyl-1-nitronaphthalene
IUPAC
2-methyl-1-nitronaphthalene
English name
2-Methyl-1-nitronaphthalene
Molecular formula
C11H9NO2
Molecular weight
187.19

Names & synonyms

2-METHYL-1-NITRONAPHTHALENE1-Nitro-2-methylnaphthaleneNaphthalene, 2-methyl-1-nitro-CCRIS 4680DTXSID2025761NSC 7516EINECS 212-917-5UNII-0IG2R1R9F7BRN 19543100IG2R1R9F7NSC-7516DTXCID105761
Show more names
2-METHYL-1-NITROPHTHALENE2-methyl-1-nitro-naphthalen2-Methyl-1-nitronaphthalene>Naphthalene, 2-Methyl-1-nitro-2-Methyl-1-nitronaphthalene,99%2-Methyl-1-nitronaphthalene, 99% 5GR2-Methyl-1-nitronaphthalene in methanol
4-05-00-01698 (Beilstein Handbook Reference)NITRO-2-METHYLNAPHTHALENE, 1-92538-34-6RefChem:88001212-917-5IZNWACYOILBFEG-UHFFFAOYSA-N881-03-8MFCD00003914

Database identifiers

CAS
881-03-8、92538-34-6
PubChem CID
13432
DTXSID
DTXSID2025761
ChEMBL
CHEMBL1452824
UNII
0IG2R1R9F7
EC Number
212-917-5
Nikkaji
J113.687I

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
45.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
0
Heavy atoms
14

Experimental & physicochemical properties

SpringerMaterials Properties13C nuclear magnetic resonance spectrum
Solubilityless than 0.1 mg/mL at 64 °F (NTP, 1992)
Boiling Point370 °F at 20 mmHg (NTP, 1992)
Melting Point174 to 180 °F (NTP, 1992)
Physical Description1-nitro-2-methylnaphthalene is a yellow solid. (NTP, 1992)

Physicochemical properties

Melting point
79 · 79-82 °C(lit.)
Boiling point
185 · 185-186 °C18 mm Hg(lit.)
Density
1.1963 · 1.1963 (rough estimate)
refractive index
1.49 · 1.4900 (estimate)
storage temp.
Keep in dark place,Sealed in dry,Room Temperature
form
powder to crystal

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Fire HazardsFlash point data are not available for this chemical, but it is probably combustible. (NTP, 1992)
Reactive GroupHydrocarbons, Aromatic
Reactivity Profile · 1 item

Aromatic nitro compounds, such as 1-NITRO-2-METHYLNAPHTHALENE, range from slight to strong oxidizing agents. If mixed with reducing agents, including hydrides, sulfides and nitrides, they may begin a vigorous reaction that culminates in a detonation. The aromatic nitro compounds may explode in the presence of a base such as sodium hydroxide or potassium hydroxide even in the presence of water or organic solvents. The explosive tendencies of aromatic nitro compounds are increased by the presence of multiple nitro groups. Stable under normal conditions. Protect from bases. (NTP, 1992)

Air and Water ReactionsInsoluble in water.
Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety & protection

Fire FightingFires involving this compound should be controlled using a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid · 1 item

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

Nonfire Spill Response · 1 item

SMALL SPILLS AND LEAKAGE: You should dampen the solid spill material with acetone, then transfer the dampened material to a suitable container. Use absorbent paper dampened with acetone to pick up any remaining material. Seal your contaminated clothing and the adsorbent paper in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with acetone followed by washing with a strong soap and water solution. Do not reenter the contaminate area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Personal Protective Equipment (PPE) · 1 item

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

Safety data

F
8
PPE
Eyeshields, Gloves, type N95 (US)
wgk
3
tsca
TSCA listed
rtecs
QJ9708200
hs_code
29042090

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationNaphthalene, 2-methyl-1-nitro-: INACTIVE

Applications

General DescriptionYellow solid.

Upstream & downstream products

Suppliers81 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]

Related reactions

1 records

Compound notes

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