174605-91-5
中文名稱
N-BOC-4-(4-氯芐基)哌啶-4-羧酸乙酯
英文名稱
Ethyl N-Boc-4-(4-chlorobenzyl)piperidine-4-carboxylate
CAS
174605-91-5
分子式
C20H28ClNO4
分子量
381.89
MOL 文件
174605-91-5.mol
174605-91-5 結(jié)構(gòu)式
基本信息
中文別名
N-BOC-4-(4-氯芐基)哌啶-4-羧酸乙酯N-BOC-4-(4-氯芐基)哌啶-4-羧酸乙酯 乙酯
英文別名
Ethyl N-Boc-4-(4-chlorobenzyl)piperidine-4-carboxylate1-TERT-BUTYL 4-ETHYL 4-(4-CHLOROBENZYL)PIPERIDINE-1,4-DICARBOXYLATE
1-o-tert-butyl 4-o-ethyl 4-[(4-chlorophenyl)methyl]piperidine-1,4-dicarboxylate
1,4-Piperidinedicarboxylic acid, 4-[(4-chlorophenyl)methyl]-, 1-(1,1-dimethylethyl) 4-ethyl ester
物理化學性質(zhì)
熔點69-73 °C
沸點455.1±35.0 °C(Predicted)
密度1.166±0.06 g/cm3(Predicted)
酸度系數(shù)(pKa)-2.41±0.40(Predicted)
形態(tài)solid
InChI1S/C20H28ClNO4/c1-5-25-17(23)20(14-15-6-8-16(21)9-7-15)10-12-22(13-11-20)18(24)26-19(2,3)4/h6-9H,5,10-14H2,1-4H3
InChIKeyQTVIWIWJGWSTDC-UHFFFAOYSA-N
SMILESCCOC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)Cc2ccc(Cl)cc2
安全數(shù)據(jù)
危險品標志T,N
危險類別碼25-36/37/38-50/53
安全說明26-45-60-61
危險品運輸編號UN 2811 6.1/PG 3
WGK Germany3
存儲類別6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
toxic compounds or compounds which causing chronic effects
危險性類別Acute Tox. 3 Oral
Aquatic Acute 1
Aquatic Chronic 1
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Aquatic Acute 1
Aquatic Chronic 1
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3