Basic information
- CAS
75867-41-3- Standard SMILES
COC(=O)c1ccc(C#C[Si](C)(C)C)cc1- InChIKey
OMKQKBOYVRHLRP-UHFFFAOYSA-N- Molecular formula
- C13H16O2Si
- Average molar mass
- 232.35 g/mol
- Monoisotopic mass
- 232.09195628
Names & identifiers
- Preferred name
- Methyl 4-trimethylsilylethynylbenzoate
- IUPAC
- methyl 4-(2-trimethylsilylethynyl)benzoate
- English name
- methyl 4-(2-(trimethylsilyl)ethynyl)benzoate
- Molecular formula
- C13H16O2Si
- Molecular weight
- 232.35
Names & synonyms
75867-41-3methyl 4-trimethylsilylethynylbenzoateDTXSID80348699RefChem:1089482DTXCID60299771Methyl 4-((trimethylsilyl)ethynyl)benzoatemethyl 4-(2-trimethylsilylethynyl)benzoateMethyl 4-(2-(trimethylsilyl)ethynyl)benzoatemethyl 4-[(trimethylsilyl)ethynyl]benzoateMFCD14635889C13H16O2SiMETHYL 4-[2-(TRIMETHYLSILYL)ETHYNYL]BENZOATE
Show more names
4-trimethylsilanylethynyl-benzoic acid methyl esterBenzoic acid, 4-[2-(trimethylsilyl)ethynyl]-, methyl ester
Methyl 4-(trimethylsilylethynyl)benzoateMethyl4-((trimethylsilyl)ethynyl)benzoateSCHEMBL168698benzoic acid, 4-[(trimethylsilyl)ethynyl]-, methyl esterOMKQKBOYVRHLRP-UHFFFAOYSA-NAB9823methyl p-trimethylsilylethynylbenzoate4-(Trimethylsilylethynyl)methylbenzoate
Database identifiers
- CAS
75867-41-3- PubChem CID
- 640161
- DTXSID
DTXSID80348699- Nikkaji
- J1.067.539A
Properties
Computed structural properties
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 308
Physicochemical properties
- Melting point
- 56 · 56-57 °C
- Boiling point
- 281.7 · 281.7±32.0 °C(Predicted)
- Density
- 1.02 · 1.02±0.1 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- Appearance
- Off-white to light brown Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers24 total
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
上海药森生物科技有限公司18916117619 18916117619
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
天成化工(江苏)有限公司0512-66387919 18662433356 · [email protected]
上海市凯瑜琳医药科技有限公司021-18721936-595 18721936595 · [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]
上海任跃化学科技有限公司021-62219190; 18321139117 · [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]
上海昂提生物科技有限公司13764913901 · [email protected]
徐州卓运新材料科技有限公司0516-0516 13776763863 · [email protected]
烟台盛凯伦化学科技有限公司13356901049 · [email protected]
上海琼燕医药科技有限公司086-021-15821262312 15821262312 · [email protected]
南京合巨药业有限公司025-57027686 17372956142 · [email protected]
海蔚化学86-21-51086038 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海有集材料有限公司13052376889 13681663468 · [email protected]
SHANGHAI YOUNG-CHEM CHEMICAL CO., LTD.13817489192 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
Related reactions
27 records
Compound notes
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