2,5-二甲基哌嗪

2,5-二甲基哌嗪 · 2,5-二甲哌【口+井】 · 2,5-二甲基哌嗪(顺,反式混合物) · (2R,5S)-2,5 - 二甲基呱嗪 · Aids060673 · Aids-060673 · TIMTEC-BB SBB004303 · 2,5-Dimethylpiperazine

标识与物理属性

CAS No.	106-55-8
分子式	C6H14N2
平均分子量	114.19 g/mol
单同位素质量	114.11569845 g/mol
SMILES	CC1CNC(C)CN1
InChIKey	NSMWYRLQHIXVAP-UHFFFAOYSA-N
PubChem CID	7816
EC No.	203-409-4
DTXSID	DTXSID70861721
中文名	2,5-二甲基哌嗪

XLogP	0
极性表面积	24.1
氢键供体	2
氢键受体	2
可旋转键	0
重原子	8
形式电荷	0
复杂度	62.9
熔点	113-118 °C
沸点	162-165 °C
密度	0.53
折射率	1.4628 (estimate)
闪点	58 °C
储存条件	2-8°C
pKa（酸度系数）	9.66(at 25℃)
InChI	InChI=1S/C6H14N2/c1-5-3-8-6(2)4-7-5/h5-8H,3-4H2,1-2H3
InChIKey	NSMWYRLQHIXVAP-UHFFFAOYSA-N
SMILES	N1CC(C)NCC1C
CAS 数据库	106-55-8(CAS DataBase Reference)
NIST化学物质信息	Piperazine, 2,5-dimethyl-(106-55-8)
EPA化学物质信息	Piperazine, 2,5-dimethyl- (106-55-8)

GHS 分类	DangerH228 (50%): Flammable solid [Danger Flammable solids]P210, P240, P241, P260, P262, P264, P270, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P361+P364, P363, P370+P378, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.H228 (100%): Flammable solid [Danger Flammable solids]
法规信息	Chemical: Piperazine, 2,5-dimethyl-Piperazine, 2,5-dimethyl-: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and Categories	Flam. Sol. 1 (50%)Flam. Sol. 1 (100%)
TSCA 清单状态	TSCA listed
毒性	rabbit,LD50,skin,800uL/kg (0.8mL/kg),AMA Archives of Industrial Hygiene and Occupational Medicine. Vol. 4, Pg. 119, 1951.
安全说明（S）	45-36/37/39-26-16
危险品标志	C-F
危险类别码（R）	34-21-11