CAS 25171-19-1 2,4-Dichloro-7-methylquinazoline (HCID 21941983)

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Basic information

CAS: 25171-19-1
Standard SMILES: Cc1ccc2c(Cl)nc(Cl)nc2c1
InChIKey: BMIRNBNLOBXVPJ-UHFFFAOYSA-N
Molecular formula: C9H6Cl2N2
Average molar mass: 213.06 g/mol
Monoisotopic mass: 211.99080355

Names & identifiers

Preferred name: 2,4-Dichloro-7-methylquinazoline
IUPAC: 2,4-dichloro-7-methylquinazoline
English name: 2,4-DICHLORO-1,2,3,4-TETRAHYDRO-7-METHYLQUINAZOLINE
Molecular formula: C9H6Cl2N2
Molecular weight: 213.06

Names & synonyms

2,4-DICHLORO-7-METHYLQUINAZOLINE25171-19-1DTXSID40620488RefChem:246309DTXCID20571242894-000-5Quinazoline, 2,4-dichloro-7-methyl-2,4-Dichloro-7-methyl-quinazolineMFCD11858254SCHEMBL1839837-methyl-2,4-dichloroquinazolineAKOS015851178

Show more names

2,4-dichloro-7-methyl-quinazoline - [D85942]2,4-DICHLORO-1,2,3,4-TETRAHYDRO-7-METHYLQUINAZOLINE

SY045950CS-0208116EN300-7421441FT-0703571SCHEMBL3001365924-Dichloro-7-methylquinazolineDS-15101DB-067334

Database identifiers

CAS: 25171-19-1
PubChem CID: 21941983
DTXSID: DTXSID40620488
EC Number: 894-000-5

Properties

Computed structural properties

XLogP: 3.8
Topological polar surface area: 25.8 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 0
Heavy atoms: 13
Formal charge: 0
Complexity: 188

Physicochemical properties

Boiling point: 292.4 · 292.4±33.0 °C(Predicted)
Density: 1.418 · 1.418±0.06 g/cm3(Predicted)
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2-8°C
pka: -0.15 · -0.15±0.30(Predicted)
Appearance: White to off-white Solid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338

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, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.