CAS 22244-22-0 MFCD01663859-Ethyl 3,4-Dihydro-2H-Benzo[b][1,4]Oxazine-2-Carboxylate 3,4-二氢-2H-苯并[b][1,4]恶嗪-2-羧酸乙酯 TAO{mole}

Ethyl 3,4-Dihydro-2H-Benzo[b][1,4]Oxazine-2-Carboxylate 3,4-二氢-2H-苯并[b][1,4]恶嗪-2-羧酸乙酯

CAS 22244-22-0 MFCD01663859

化学结构图

SMILES: CCOC(=O)C1CNC2C=CC=CC=2O1

化学属性

Mol. Formula	C11H13NO3
Mol. Weight	207
Melting Point	Oil (°C)

别名和识别编码

Chemical Name	Ethyl 3,4-Dihydro-2H-Benzo[b][1,4]Oxazine-2-Carboxylate
CAS Number	22244-22-0
Alfabeta Name	ETHYLDIHYDROBENZOXAZINECARBOXYLATE H342142------,,
MDL Number	MFCD01663859
Synonym	3,4-Dihydro-2H-1,4-benzoxazine-2-carboxylic acid ethyl ester Ethyl 3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate
Wiswesser Line Notation	T66 BN EOT&J DVO2
Beilstein Registry Number	0990855
PubChem Substance ID	329790454
Chemical Name Translation	3,4-二氢-2H-苯并[b][1,4]恶嗪-2-羧酸乙酯

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安全信息

Warnings IRRITANT

RTECSDM3004000

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 500 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   DPHFAK Dissertationes Pharmaceuticae et Pharmacologicae.  (Warsaw, Poland)
   V.18-24, 1966-72.  For publisher information, see PJPPAA.
   Volume(issue)/page/year: 21,25,1969

WGK Germany3

GHS Symbol

Precautionary statements

P273 Avoid release to the environment. 避免释放到环境中。

Signal word Warning

Hazard statements

H411 Toxictoaquaticlifewithlonglastingeffects 对水生生物有毒性并具有长期影响。
H302 Harmful if swallowed 吞食有害

Hazard Codes Xn

Risk Statements

R51 Toxic to aquatic organisms 对水生生物有毒
R22 Harmful if swallowed 吞咽有害

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 3

Lipinski's Rule of 5

H-bond Donors

H-bond Acceptors

Rotatable Bonds

LogP