1,4-Difluoro-2-methyl-5-nitrobenzene

HCID 230658

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Basic information

CAS: 141412-60-4
Standard SMILES: Cc1cc(F)c([N+](=O)[O-])cc1F
InChIKey: ABWWQMGGJXKGBL-UHFFFAOYSA-N
Molecular formula: C7H5F2NO2
Average molar mass: 173.12 g/mol
Monoisotopic mass: 173.02883484

Names & identifiers

Preferred name: 1,4-Difluoro-2-methyl-5-nitrobenzene
IUPAC: 1,4-difluoro-2-methyl-5-nitrobenzene
English name: 1,4-Difluoro-2-methyl-5-nitrobenzene
Molecular formula: C7H5F2NO2
Molecular weight: 173.12

Names & synonyms

1,4-difluoro-2-methyl-5-nitrobenzene141412-60-4DTXSID20282407RefChem:220506DTXCID70233560834-036-02,5-Difluoro-4-nitrotoluene2,5-Difluoro-4-methylnitrobenzeneMFCD062009051,4-difluoro-2-methyl-5-nitro-benzeneAKOS005069259AC-9711

Show more names

2-Difluoro-4-nitrotoluene2，5-Difluoro-4-nitrotoluene4-DIFLUORO-2-METHYL-5-NITROBENZENE1,4-DIFLUORO-2-METHYL-5-NITROBENZENE ISO 9001：2015 REACH1,4-Difluoro-2-Methyl-5-nitrobenzene[2,5-difluoro-4-nitrotoluene]2,5-Difluoro-4-methylnitrobenzene, 1,4-Difluoro-2-methyl-5-nitrobe

SY018800D480610R-0045BENZENE, 1,4-DIFLUORO-2-METHYL-5-NITRO-2,5-difluoro-4-methyinitrobenzeneBCP24547NSC257592,5-difluoro-1-methyl-4-nitrobenzene

Database identifiers

CAS: 141412-60-4
PubChem CID: 230658
DTXSID: DTXSID20282407
EC Number: 834-036-0

Properties

Computed structural properties

XLogP: 2.3
Topological polar surface area: 45.8 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 4
Rotatable bonds: 0
Heavy atoms: 12
Formal charge: 0
Complexity: 183

Physicochemical properties

Melting point: 25 °C · 25 °C
Boiling point: 251 · 251 ºC
Density: 1.374 · 1.374
Flash point: 121 · 121 ºC
storage temp.: Sealed in dry,Room Temperature
form: powder to lump to clear liquid
color: White or Colorless to Yellow to Green
CAS DataBase Reference: 141412 · 141412-60-4(CAS DataBase Reference)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302+H312+H332-H315-H319
Precautionary statements: 261 · P261-P264-P270-P271-P280-P301+P312+P330-P302+P352+P312+P362+P364-P304+P340+P312-P305+P351+P338+P337+P313-P501
Hazard Codes: Xi
HazardClass: IRRITANT
HS Code: 2904990090 · 2904990090

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302+H312+H332 (50%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]

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

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

hs_code: 2904990090
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
hazard_class: IRRITANT
Hazard statements: H302+H312+H332-H315-H319
Precautionary statements: P261-P264-P270-P271-P280-P301+P312+P330-P302+P352+P312+P362+P364-P304+P340+P312-P305+P351+P338+P337+P313-P501