2,2'-((1-메틸에틸리덴)비스(시클로헥산-4,1-디일옥시메틸렌))비스옥시란

2,2'-((1-Methylethylidene)bis(cyclohexane-4,1-diyloxymethylene))bisoxirane

HCID 114514

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 13410-58-7
표준 SMILES: CC(C)(C1CCC(OCC2CO2)CC1)C1CCC(OCC2CO2)CC1
InChIKey: GZPRASLJQIBVDP-UHFFFAOYSA-N
분자식: C21H36O4
평균 분자량: 352.5 g/mol
단동위원소 질량: 352.26135963

이름 및 식별자

우선 이름: 2,2'-((1-Methylethylidene)bis(cyclohexane-4,1-diyloxymethylene))bisoxirane
IUPAC: 2-[[4-[2-[4-(oxiran-2-ylmethoxy)cyclohexyl]propan-2-yl]cyclohexyl]oxymethyl]oxirane
현지명: 2,2'-((1-메틸에틸리덴)비스(시클로헥산-4,1-디일옥시메틸렌))비스옥시란
영어명: 2,2'-((1-Methylethylidene)bis(cyclohexane-4,1-diyloxymethylene))bisoxirane
분자식: C21H36O4
분자량: 352.51

이름 및 동의어

2,2'-((1-Methylethylidene)bis(cyclohexane-4,1-diyloxymethylene))bisoxiraneEINECS 236-502-32,2'-[(1-methylethylidene)bis(cyclohexane-4,1-diyloxymethylene)]bisoxiraneRefChem:440040236-502-313410-58-72-[[4-[2-[4-(oxiran-2-ylmethoxy)cyclohexyl]propan-2-yl]cyclohexyl]oxymethyl]oxiraneHydrogenated bisphenol A diglycidyl ether2,2-[(1-methylethylidene)bis(cyclohexane-4,1-diyloxymethylene)]bisoxirane2,2'-(((propane-2,2-diylbis(cyclohexane-4,1-diyl))bis(oxy))bis(methylene))bis(oxirane)2,2/'-((1-Methylethylidene)bis(cyclohexane-4,1-diyloxymethylene))bisoxirane2,2-Bis[4-(glycidyloxy)cyclohexyl]propane

이름 더 보기

2,2'-((1-메틸에틸리덴)비스(시클로헥산-4,1-디일옥시메틸렌))비스옥시란YL-66632,2'-[Dimethylmethylenebis[(1,4-cyclohexanediyloxy)methylene]]bisoxirane2,2'-[Isopropylidenebis[(cyclohexane-4,1-diyl)(oxy)(methylene)]]di(oxirane)Oxirane,2,2'-[(1-methylethylidene)bis(4,1-cyclohexanediyloxymethylene)]bis-

2,2-bis[4-(2,3-epoxypropoxy)cyclohexyl]propaneSCHEMBL50372DTXSID10928443perhydrobisphenol A diglycidyl etherBisphenol A diglycidyl ether, hydrogenatedNS000538582,2'-[(1-methylethylidene)bis(4,1-cyclohexanediyloxymethylene)]bis-Oxirane2,2'-[(Dimethylmethylene)bis(cyclohexane-4,1-diyloxymethylene)]bisoxirane

데이터베이스 식별자

CAS: 13410-58-7、26283-70-5
PubChem CID: 114514
DTXSID: DTXSID10928443
EC Number: 236-502-3
Nikkaji: J317.863C

물성

구조 계산 물성

XLogP: 3.6
극성 표면적: 43.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 8
무거운 원자 수: 25
형식 전하: 0
복잡도: 384

물리화학적 성질

끓는 점: 465.1 · 465.1±20.0 °C(Predicted)
밀도: 1.07 · 1.07±0.1 g/cm3(Predicted)
증기압: 0 Pa · 0Pa at 25℃
수용성: 63.1 mg/L · 63.1mg/L at 20℃
InChI: InChI=1S/C21H36O4/c1-21(2,15-3-7-17(8-4-15)22-11-19-13-24-19)16-5-9-18(10-6-16)23-12-20-14-25-20/h15-20H,3-14H2,1-2H3
InChIKey: GZPRASLJQIBVDP-UHFFFAOYSA-N
SMILES: C(C1CCC(OCC2CO2)CC1)(C1CCC(OCC2CO2)CC1)(C)C
LogP: 4 at · 4 at 25℃
EPA: 2 · Oxirane, 2,2'-[(1-methylethylidene)bis(4,1-cyclohexanediyloxymethylene)]bis- (13410-58-7)

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (33.3%): Causes skin irritation [Warning Skin corrosion/irritation]；H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]；H319 (33.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H411 (66.7%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]；H412 (33.3%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P261, P264, P264+P265, P272, P273, P280, P302+P352, P305+P351+P338, P321, P332+P317, P333+P317, P337+P317, P362+P364, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 165 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Regulatory InformationStatus: Active Update: 26-01-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/24906

Hazard Classes and CategoriesSkin Irrit. 2 (33.3%)；Skin Sens. 1 (100%)；Eye Irrit. 2 (33.3%)；Aquatic Chronic 2 (66.7%)；Aquatic Chronic 3 (33.3%)

규제 정보

Regulatory InformationStatus: Active Update: 26-01-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/24906

안전 데이터

신호 어: Warning
유해·위험 문구: 암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드 H317

화학 및 산업

공급사9 곳

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]

陕西晶和医药科技有限公司029-86062279 13324594253 · [email protected]

XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]

合肥钼凯医药科技有限公司18130062233 · [email protected]

重庆卡兰医药有限公司[email protected]

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