Hexamethylene Bisacetamide

N,N'-HEXAMETHYLENEBISACETAMIDE · N,N'-(Hexane-1,6-diyl)diacetamide · NSC-95580 · N,N′1,6-DIACETAMIDOHEXANE · 1,6-Hexanebisacetamide · Hexamethylenediacetamide · hexamethylenebisacetamide · HEXAMETHYLENE BISCETAMIDE

https://huagongshe.com/ko/chemical/3616

식별자 및 물리적 특성

CAS No.	3073-59-4
분자식	C10H20N2O2
평균 분자량	200.28 g/mol
단동위원소 질량	200.15247788 g/mol
SMILES	CC(=O)NCCCCCCNC(C)=O
InChIKey	BNQSTAOJRULKNX-UHFFFAOYSA-N
PubChem CID	3616
ChEMBL	CHEMBL291481
ChEBI	CHEBI:125472
DTXSID	DTXSID2041044

화학 및 물리적 성질

XLogP	0.3
극성 표면적	58.2
수소 결합 공여자 수	2
수소 결합 수용자 수	2
회전 가능 결합 수	7
무거운 원자 수	14
형식 전하	0
복잡도	161
용해도	H2O > 50 (mg/mL)pH 4 Acetate buffer > 50 (mg/mL)pH 9 Carbonate buffer > 50 (mg/mL)0.1 N NaOH > 50 (mg/mL)0.1 N HCL > 50 (mg/mL)10% Ethanol > 50 (mg/mL)물: 가용성 5%, 투명, 무색
Stability/Shelf Life	Bulk: A sample stored at 60°C in the dark for 30 days retained 99 2% of its potency (GC). Solution: Samples were dissolved in water at a concentration of 20 mg/mL and stored in clear glass containers at room temperatures under normal laboratory light for 9 days. The sample retained 98 2% of its potency (GC).
녹는점	128-129 °C(lit.)
끓는 점	338.01°C (rough estimate)
밀도	0.974
굴절률	1.4710 (estimate)
저장 조건	Sealed in dry,Room Temperature
물리적 상태	고체
pKa(산도 계수)	16.20±0.46(Predicted)
색상	White to off-white
용해도	water: soluble 5%, clear, colorless
BRN	1775764
InChI	InChI=1S/C10H20N2O2/c1-9(13)11-7-5-3-4-6-8-12-10(2)14/h3-8H2,1-2H3,(H,11,13)(H,12,14)
InChIKey	BNQSTAOJRULKNX-UHFFFAOYSA-N
SMILES	C(NC(=O)C)CCCCCNC(=O)C

화학적 성질

white crystalline powder or flakes

안전 및 규제

수질 위해 등급(WGK)	3
RTECS 번호	AC2976200
독성	human,TDLo,intravenous,4270mg/kg/10D (4270mg/kg),GASTROINTESTINAL: NAUSEA OR VOMITINGBLOOD: THROMBOCYTOPENIA,Cancer Research. Vol. 47, Pg. 5788, 1987.
관세 코드	29241990
위험 문구(R)	33
안전 문구(S)	22-24/25
저장 분류	11 - Combustible Solids

용도

N,N′-Hexamethylene bis(acetamide) was used as an inducing agent in obtaining mononuclear cells from the peripheral blood (PB) sample by Ficoll-Hypaque gradient separation.