Basic information
- CAS
1352492-38-6- Standard SMILES
C#CC1(O)COC1- InChIKey
VDKFNBYHNNAJBC-UHFFFAOYSA-N- Molecular formula
- C5H6O2
- Average molar mass
- 98.1 g/mol
- Monoisotopic mass
- 98.03677943
Names & identifiers
- Preferred name
- 3-Ethynyl-3-oxetanol
- IUPAC
- 3-ethynyloxetan-3-ol
- English name
- 3-Ethynyloxetan-3-ol
- Molecular formula
- C5H6O2
- Molecular weight
- 98.1
Names & synonyms
3-ethynyloxetan-3-ol1352492-38-63-Ethynyl-3-oxetanolDTXSID101315227RefChem:501512DTXCID701745131869-119-0MFCD20444449AKOS016015634PB19733SY097262CS-0051375
Show more names
3-Oxetanol, 3-ethynyl-3-Ethynyl oxetane-3-ol3-ethynyloxetan-3-ol 97%min3-Ethynyloxetan-3-ol - [E6671]
EN300-180177FT-07239663-Ethynyl-3-hydroxyoxetaneA887713SCHEMBL11971096DA-11644F466902
Database identifiers
- CAS
1352492-38-6- PubChem CID
- 56777520
- DTXSID
DTXSID101315227- EC Number
- 869-119-0
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 115
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- form
- crystalline solid
- color
- White
- Symbol(GHS)
- 5 · GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 302 · H302-H315-H318-H335
- Precautionary statements
- 280 · P280-P312
- HS Code
- 2934999090 · 2934999090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2934999090
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- Hazard statements
- H302-H315-H318-H335
- Precautionary statements
- P280-P312
Chemistry & industry
Applications
Uses3-Ethynyloxetan-3-ol can be used as RIP1 inhibitors to treat or prevent kinase-associated diseases
Suppliers52 total
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
天津长江化学有限公司19129375004; 15321929114 · [email protected]
镇江迪艾生物科技有限公司18912101619
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
重庆诺森医药有限公司15310618205 · [email protected]
Aladdin Scientific[email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
山东大有药物研发有限公司[email protected] 15165037910 · [email protected]
欧利希（湖北）医药科技有限公司17316404525 17316404525 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
上海相辉医药科技有限公司
Related reactions
1 records
Compound notes
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