3,9-비스(2-하이드록시-1,1-디메틸에틸)-2,4,8,10-테트라옥사피로[5.5]운데칸

beta3,beta3,beta9,beta9-Tetramethyl-2,4,8,10-tetraoxaspiro(5.5)undecane-3,9-diethanol

HCID 7569008

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 1455-42-1
표준 SMILES: CC(C)(CO)C1OCC2(CO1)COC(C(C)(C)CO)OC2
InChIKey: BPZIYBJCZRUDEG-UHFFFAOYSA-N
분자식: C15H28O6
평균 분자량: 304.38 g/mol
단동위원소 질량: 304.18858861

이름 및 식별자

우선 이름: beta3,beta3,beta9,beta9-Tetramethyl-2,4,8,10-tetraoxaspiro(5.5)undecane-3,9-diethanol
IUPAC: 2-[3-(1-hydroxy-2-methylpropan-2-yl)-2,4,8,10-tetraoxaspiro[5.5]undecan-9-yl]-2-methylpropan-1-ol
현지명: 3,9-비스(2-하이드록시-1,1-디메틸에틸)-2,4,8,10-테트라옥사피로[5.5]운데칸
영어명: 3,9-Bis(1,1-dimethyl-2-hydroxyethyl)-2,4,8,10-tetraoxaspiro[5.5]undecane
분자식: C15H28O6
분자량: 304.38

이름 및 동의어

1455-42-1DTXSID10754342,4,8,10-Tetraoxaspiro(5.5)undecane-3,9-diethanol, beta3,beta3,beta9,beta9-tetramethyl-2,4,8,10-Tetraoxaspiro[5.5]undecane-3,9-diethanol, beta3,beta3,beta9,beta9-tetramethyl-2,4,8,10-Tetraoxaspiro(5.5)undecane-3,9-diethanol, beta,beta,beta',beta'-tetramethyl-RefChem:1079722DTXCID4034734beta3,beta3,beta9,beta9-Tetramethyl-2,4,8,10-tetraoxaspiro(5.5)undecane-3,9-diethanol604-479-23,9-Bis(1,1-dimethyl-2-hydroxyethyl)-2,4,8,10-tetraoxaspiro[5.5]undecane2,2'-(2,4,8,10-Tetraoxaspiro[5.5]undecane-3,9-diyl)bis(2-methylpropan-1-ol)C15H28O6

이름 더 보기

3,9-비스(2-하이드록시-1,1-디메틸에틸)-2,4,8,10-테트라옥사피로[5.5]운데칸spirodiolSPIROGLYCOL3,9-BIS(1,1-DIMETHYL-2-HYDROXYETHYL)-2,4,8,10-TETRAOXASPIRO[BIS(HYDROXYPIVALALDEHYDE) PENTAERYTHRITOLACETAL CYCLIC ACETAL2,2-Dimethyl-3-hydroxypropionaldehyde pentaerythrityl bisacetal3,9-Bis(1,1-dimethyl-2-hydroxyethyl)-2,4,8,10-tetraoxaspiro[5.5]undec3,9-Bis(2-hydroxy-1,1-dimethylethyl)-2,4,8,10-tetraoxaspiro[5.5]undecane2,4,8,10-Tetraoxaspiro[5.5]undecane-3,9-diethanol, β3,β3,β9,β9-tetramethyl-

MFCD00059794SCHEMBL44322BAA45542AKOS015841774CS-W0120982-[3-(1-hydroxy-2-methylpropan-2-yl)-2,4,8,10-tetraoxaspiro[5.5]undecan-9-yl]-2-methylpropan-1-ol2,4,8,10-Tetraoxaspiro[5.5]undecane-3,9-diethanol, .beta.,.beta.,.beta.',.beta.'-tetramethyl-FT-0614789

데이터베이스 식별자

CAS: 1455-42-1
PubChem CID: 7569008
DTXSID: DTXSID1075434
EC Number: 485-230-3、604-479-2、932-643-6
Nikkaji: J40.646E

물성

구조 계산 물성

XLogP: 0.6
극성 표면적: 77.4 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 6
회전 가능 결합 수: 4
무거운 원자 수: 21
형식 전하: 0
복잡도: 301

물리화학적 성질

녹는점: 198 · 198-200°C
끓는 점: 434.2 · 434.2±40.0 °C(Predicted)
밀도: 1.16 · 1.16
증기압: 0 Pa · 0Pa at 25℃
저장 조건: Sealed in dry,Room Temperature
용해도: almost transparency in hot Methanol
물리적 상태: powder to crystal
산도 계수 (pKa): 14.38 · 14.38±0.10(Predicted)
색상: 흰색에서 거의 흰색
수용성: 168 mg/L · 168mg/L at 20℃
BRN: 1574570 · 1574570
InChI: InChI=1S/C15H28O6/c1-13(2,5-16)11-18-7-15(8-19-11)9-20-12(21-10-15)14(3,4)6-17/h11-12,16-17H,5-10H2,1-4H3
InChIKey: BPZIYBJCZRUDEG-UHFFFAOYSA-N
SMILES: C12(COC(C(C)(C)CO)OC1)COC(C(C)(C)CO)OC2
LogP: 1.63 at · 1.63 at 30℃
EPA: 2 · 2,4,8,10-Tetraoxaspiro[5.5]undecane-3,9-diethanol, .beta.,.beta.,.beta.',.beta.'-tetramethyl- (1455-42-1)

화학적 성질

White powder

안전 및 규제

GHS 분류

GHS Classification · 4건

This chemical does not meet GHS hazard criteria for 100% (2 of 2) of all reports.

Not Classified；Reported as not meeting GHS hazard criteria by 2 of 2 companies. For more detailed information, please visit ECHA C&L website.

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 2 of 2 reports by companies.；There are 0 notifications provided by 0 of 2 reports by companies with hazard statement code(s).；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.

Not Classified；Reported as not meeting GHS hazard criteria by 1 of 1 companies. For more detailed information, please visit ECHA C&L website.

유해성 정보

Regulatory Information · 3건

Regulation (EC) No 1935/2004 (amended)

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Status: Active Update: 26-08-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/13316

Hazard Classes and Categories · 2건

Not Classified

규제 정보

Regulatory Information · 3건

Regulation (EC) No 1935/2004 (amended)

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Status: Active Update: 26-08-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/13316

안전 데이터

tsca: TSCA listed
HS 번호: 29329990
safety_code: 22-24/25
기존화학 물질: KE-03175

화학 및 산업

용도 및 제조

General Manufacturing Information2,4,8,10-Tetraoxaspiro[5.5]undecane-3,9-diethanol, .beta.3,.beta.3,.beta.9,.beta.9-tetramethyl-: ACTIVE

공급사100 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

上海沛灵生物科技有限公司13127581762 13127581762 · [email protected]

郑州阿尔法化工有限公司+86-18530059196 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

深圳市星凯越生物科技有限公司0755-18589069862 18589069862 · [email protected]

화합물 노트

불러오는 중…