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3817-05-8

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3817-05-8 Structure

3817-05-8 Structure
IdentificationBack Directory
[Name]

2-(CHLOROMETHYL)-4(3H)-QUINAZOLINONE
[CAS]

3817-05-8
[Synonyms]

2-(Chloromethyl)quinazlin-4-ol
2-ChloroMethyl-3H-quinazolin-4-one
2-ChloroMethyl-1H-quinazolin-4-one
2-Chloromethyl-4-(3H)-quinozolinone
2-(Chloromethyl)-4(1H)-quinazolinone
2-(Chloromethyl)-4(3H)-quinazolinone 97%
2-(chloroMethyl)-3,4-dihydroquinazolin-4-one
JR-8343, 2-Chloromethyl-4-(3H)-quinazolinone, 97%
[Molecular Formula]

C9H7ClN2O
[MDL Number]

MFCD01927196
[MOL File]

3817-05-8.mol
[Molecular Weight]

194.62
Chemical PropertiesBack Directory
[Melting point ]

249-253 °C(lit.)
[Boiling point ]

340.7±44.0 °C(Predicted)
[density ]

1.42
[storage temp. ]

-20°C, sealed storage, away from moisture
[form ]

crystalline powder
[pka]

1.26±0.20(Predicted)
[color ]

White
[InChI]

InChI=1S/C9H7ClN2O/c10-5-8-11-7-4-2-1-3-6(7)9(13)12-8/h1-4H,5H2,(H,11,12,13)
[InChIKey]

KSLWZHWJFFDMMK-UHFFFAOYSA-N
[SMILES]

N1C2=C(C=CC=C2)C(=O)NC=1CCl
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H317-H319
[Precautionary statements ]

P280-P305+P351+P338
[Hazard Codes ]

Xn
[Risk Statements ]

22-36-43
[Safety Statements ]

26-36/37
[WGK Germany ]

3
[HS Code ]

2933998090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Irrit. 2
Skin Sens. 1
Spectrum DetailBack Directory
[Spectrum Detail]

2-(CHLOROMETHYL)-4(3H)-QUINAZOLINONE(3817-05-8)1HNMR
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