CAS 58230-69-6 N-(4-Amino-o-tolyl)-4-chlorophthalimide (HCID 93991)

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Basic information

CAS: 58230-69-6
Standard SMILES: Cc1cc(N)ccc1N1C(=O)c2ccc(Cl)cc2C1=O
InChIKey: LIVAQMJLPOCEMO-UHFFFAOYSA-N
Molecular formula: C15H11ClN2O2
Average molar mass: 286.71 g/mol
Monoisotopic mass: 286.05090527

Names & identifiers

Preferred name: N-(4-Amino-o-tolyl)-4-chlorophthalimide
IUPAC: 2-(4-amino-2-methylphenyl)-5-chloroisoindole-1,3-dione
English name: N-(4-AMINO-2-METHYLPHENYL)-4-CHLOROPHTHALIMIDE
Molecular formula: C15H11ClN2O2
Molecular weight: 286.71

Names & synonyms

58230-69-6N-(4-Amino-o-tolyl)-4-chlorophthalimideEINECS 261-173-8DTXSID202069662-(4-Amino-2-methylphenyl)-5-chloro-1H-isoindole-1,3(2H)-dioneRefChem:827109DTXCID50129457261-173-8N-(4-Amino-2-methylphenyl)-4-chlorophthalimide2-(4-Amino-2-methylphenyl)-5-chloroisoindoline-1,3-dione2-(4-amino-2-methylphenyl)-5-chloroisoindole-1,3-dioneMFCD00005892

Show more names

AKOS BBS-00007963TIMTEC-BB SBB001168OTAVA-BB BB01251602432-(4-Amino-2-methylphenyl)-5-chloro-1,3-isoindolinedione2-(2-Methyl-4-aminophenyl)-5-chloro-2H-isoindole-1,3-dione

N-[4-Amino-2-methylphenyl]-4-chlorophthalimide2-(4-amino-2-methylphenyl)-5-chlorobenzo[c]azoline-1,3-dioneOprea1_160116SCHEMBL1548403LIVAQMJLPOCEMO-UHFFFAOYSA-SBB0011682-(4-amino-2-methylphenyl)-5-chloro-2,3-dihydro-1H-isoindole-1,3-dioneAKOS000274102

Database identifiers

CAS: 58230-69-6

Properties

Computed structural properties

XLogP: 2.8
Topological polar surface area: 63.4 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 20
Formal charge: 0
Complexity: 428

Physicochemical properties

Melting point: 208 · 208-210 °C(lit.)
Boiling point: 519 · 519.0±60.0 °C(Predicted)
Density: 1.453 · 1.453±0.06 g/cm3(Predicted)
pka: 4.85 · 4.85±0.10(Predicted)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 335 · H335-H319-H315
Precautionary statements: 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26-37/39
WGK Germany: 3 · 3

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

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

Aggregated GHS information provided per 39 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 CategoriesSkin Irrit. 2 (100%)

Safety data

wgk: 3
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
safety_code: 26-37/39
Hazard statements: H335-H319-H315
Precautionary statements: P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362