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4-(tert-Butyldimethylsiloxy)phenol

HCID 597388
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
108534-47-0
Standard SMILES
CC(C)(C)[Si](C)(C)Oc1ccc(O)cc1
InChIKey
KZTVHIZALLBXMO-UHFFFAOYSA-N
Molecular formula
C12H20O2Si
Average molar mass
224.37 g/mol
Monoisotopic mass
224.12325641

Names & identifiers

Preferred name
4-(tert-Butyldimethylsiloxy)phenol
IUPAC
4-[tert-butyl(dimethyl)silyl]oxyphenol
English name
4-(tert-Butyldimethylsilyloxy)phenol 9&
Molecular formula
C12H20O2Si
Molecular weight
224.37

Names & synonyms

108534-47-04-(tert-Butyldimethylsiloxy)phenolDTXSID20344498RefChem:516962DTXCID80295573625-715-04-((tert-butyldimethylsilyl)oxy)phenol4-[(tert-butyldimethylsilyl)oxy]phenol4-[tert-butyl(dimethyl)silyl]oxyphenolMFCD06200713Phenol, 4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-4-(TERT-BUTYLDIMETHYLSILYLOXY)PHENOL9&
Show more names
DK4714-(tert-Butyldimethylsilyloxy)phenol 9&4-(TERT-BUTYLDIMETHYLSILYLOXY)PHENOL 9&4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]phenol
4-(tert-butyldimethylsilyloxy)phenol4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]PhenolPhenol, 4-t-butyldimethylsilyloxy-SCHEMBL173365Hydroquinone, TBDMS derivative4-tert-butyldimethylsilyloxyphenol4-(t-Butyldimethylsilyloxy)PhenolPhenol,4-t-butyldimethylsilyloxy;

Database identifiers

CAS
108534-47-0
PubChem CID
597388
DTXSID
DTXSID20344498
EC Number
625-715-0

Properties

Computed structural properties

Topological polar surface area
29.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
15
Formal charge
0
Complexity
200

Physicochemical properties

Melting point
60 · 60-64 °C (lit.)
Boiling point
266.4 · 266.4±23.0 °C(Predicted)
Density
0.974 · 0.974±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C, stored under nitrogen
pka
10.24 · 10.24±0.15(Predicted)
form
Powder
color
White to off-white
Hydrolytic Sensitivity
7 · 7: reacts slowly with moisture/water
InChI
1S/C12H20O2Si/c1-12(2,3)15(4,5)14-11-8-6-10(13)7-9-11/h6-9,13H,1-5H3
InChIKey
KZTVHIZALLBXMO-UHFFFAOYSA-N
SMILES
CC(C)(C)[Si](C)(C)Oc1ccc(O)cc1
UNSPSC Code
12352100 · 12352100
NACRES
22 · NA.22
Symbol(GHS)
5 · GHS05
Signal word
Danger
Hazard statements
318 · H318

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]

P264+P265, P280, P305+P354+P338, and P317 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesEye Dam. 1 (100%)

Safety data

PPE
dust mask type N95 (US), Eyeshields, Gloves
wgk
3
tsca
No
risk_code
41
Signal word
Danger
Symbol(GHS)
GHS05
hazard_code
Xi
safety_code
26-39
Storage Class
11 - Combustible Solids
Hazard statements
H318
Hazard Classifications
Eye Dam. 1
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Suppliers67 total

郑州阿尔法化工有限公司+86-18530059196 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
河南多贝化工有限公司0370-6999054 17550096163 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
Junwee Chemical co., Ltd.+86-571-85808636 +86-13958122542 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
阿法埃莎(中国)化学有限公司400-6106006 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13318593351 · [email protected]
安徽合诺生物科技有限公司18455579438
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
海济医药科技(苏州)有限公司18012778619 · [email protected]

Related reactions

27 records
New reaction record
HRID 68209 reaction equation
HRID 68209As productuspto-grants-2014_09
HRID 77449 reaction equation
HRID 77449As reactantuspto-grants-2014_09
HRID 175371 reaction equation
HRID 175371As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 179088 reaction equation
HRID 179088As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 196862 reaction equation
HRID 196862As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 221632 reaction equation
HRID 221632As productuspto-grants-2012_06
HRID 221634 reaction equation
HRID 221634As reactantuspto-grants-2012_06
HRID 504996 reaction equation
HRID 504996As productuspto-grants-2010_08
Page 1 of 4

Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Nikkaji
J888.411K
Precautionary statements
280 · P280-P305+P351+P338
PPE
95 · dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes
Xi
Risk Statements
41 · 41
Safety Statements
26 · 26-39
WGK Germany
3 · 3
TSCA
No
Storage Class
11 · 11 - Combustible Solids
Hazard Classifications
1 · Eye Dam. 1
上海相辉医药科技有限公司13761987713; 13761987713 · [email protected]
上海泰坦科技股份有限公司400-6009262 15618770481 · [email protected]
Zhejiang J&C Biological Technology Co.,Limited+1-2135480471 · [email protected]
ChemeGen 中国18818260767 · [email protected]
广州科瑞生物技术有限公司20-66003216 18666003216 · [email protected]
上海祈铭新材料有限公司021-36010885 13661599081;13701898138 · [email protected]
Shanghai MOF Chemical Tech Limited13661494087 18964793018 · [email protected]
Shanghai Zhuangming Biopharma Co., Ltd.+86-2158073036 17312391916 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
上海探圭新材料科技有限公司18516111942 · [email protected]
湖南华腾制药有限公司400-8592883 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
天津荣燊化工有限公司18317763565; 18317763565 · [email protected]
Shanghai Enchem Industry Co., Ltd.15021317485
壮铭新材料科技江苏有限公司17312398916 051386936896 15216715905 · [email protected]
北京建强伟业科技有限公司(FUSION弗珍试剂品牌)0531-88924771 15614660963 · [email protected]
安阳鸿蒙新材料有限公司19588588067 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海昂提生物科技有限公司13764913901 · [email protected]
安阳鸿蒙新材料有限公司0372-19588588067 19588588067 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
深圳市创鑫生物科技有限公司13417589054 · [email protected]
上海鑫矽新材料有限公司13585834793 · [email protected]
上海圭景新材料科技有限公司18616507986
徐州卓运新材料科技有限公司0516-0516 13776763863 · [email protected]
新亚强硅化学股份有限公司19921372399 · [email protected]
Shanghai Daken Advanced Materials Co.,Ltd+86-2158073036 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
苏州矽索新材料有限公司(生产型企业)0512-65402974 18550909935 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
艾览(上海)化工科技有限公司400-668-9898 · [email protected]
上海晶石医药科技有限公司021-000000 · [email protected]
郑州艾克姆化工有限公司037163312495 13303845143 · [email protected]
深圳利斯康医药科技有限公司+86-755-89396905 +86-15013857715 · [email protected]
安徽硅创新材料科技有限公司17201714774
Aladdin Scientific[email protected]