Basic information
- CAS
17356-19-3- Standard SMILES
C#CC1(O)CCCC1- InChIKey
LQMDOONLLAJAPZ-UHFFFAOYSA-N- Molecular formula
- C7H10O
- Average molar mass
- 110.15 g/mol
- Monoisotopic mass
- 110.07316494
Names & identifiers
- Preferred name
- 1-Ethynylcyclopentanol
- IUPAC
- 1-ethynylcyclopentan-1-ol
- English name
- 1-Ethynylcyclopentanol
- Molecular formula
- C7H10O
- Molecular weight
- 110.15
Names & synonyms
1-Ethynylcyclopentanol17356-19-3Cyclopentanol, 1-ethynyl-1-Ethynyl-1-cyclopentanolDTXSID2066191AI3-37705EINECS 241-385-7NSC 134047RefChem:75792DTXCID4035542241-385-7InChI=1/C7H10O/c1-2-7(8)5-3-4-6-7/h1,8H,3-6H
Show more names
1-ethynyl-cyclopentano1-Ethynylcyclopentyl alcohol1-Ethynylcyclopentanol, 98+%cyclopentyl ethynyl carbinol1-(1-ETHYNYL)-1-CYCLOPENTANOL1-ETHYNYL-1-CYCLOPENTANOL, 98+%
LQMDOONLLAJAPZ-UHFFFAOYSA-N1-ethynylcyclopentan-1-olMFCD000013651-ethynyl-cyclopentan-1-ol6LB5RD2XU4UNII-6LB5RD2XU41-Ethynylcyclopentanol, 98%AKOS005454374
Database identifiers
- CAS
17356-19-3- PubChem CID
- 87074
- DTXSID
DTXSID2066191- UNII
- 6LB5RD2XU4
- EC Number
- 241-385-7
- Nikkaji
- J236.154J
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 123
Physicochemical properties
- Melting point
- 27 °C · 27 °C
- Boiling point
- 156 · 156-159 °C(lit.)
- Density
- 0.962 g/mL · 0.962 g/mL at 25 °C(lit.)
- refractive index
- 20 · n20/D 1.474(lit.)
- Flash point
- 120 °F · 120 °F
- storage temp.
- 2 · Sealed in dry,2-8°C
- pka
- 13.34 · 13.34±0.20(Predicted)
- Appearance
- Colorless to light yellow Liquid
- Water Solubility
- Insoluble in water.
- BRN
- 1924167 · 1924167
- InChI
- InChI=1S/C7H10O/c1-2-7(8)5-3-4-6-7/h1,8H,3-6H2
- InChIKey
- LQMDOONLLAJAPZ-UHFFFAOYSA-N
- SMILES
- C1(C#C)(O)CCCC1
- CAS DataBase Reference
- 17356 · 17356-19-3(CAS DataBase Reference)
- FDA UNII
- 6 LB5RD2XU4 · 6LB5RD2XU4
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
Warning
H226 (88.9%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 45 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: Cyclopentanol, 1-ethynyl-
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Hazard Classes and CategoriesFlam. Liq. 3 (88.9%)
Safety data
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 1986 3/PG 3
- hs_code
- 29061990
- risk_code
- 10-36/37
- Signal word
- Warning
- Symbol(GHS)
- GHS02,GHS07
- hazard_code
- Xi
- safety_code
- 16-26-27-36/37/39
- hazard_class
- 3
- Storage Class
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationCyclopentanol, 1-ethynyl-: ACTIVE
Applications
Uses1-Ethynylcyclopentanol is used in organic synthesis.
Suppliers69 total
国药集团化学试剂有限公司86-21-63210123 · [email protected]
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
镇江迪艾生物科技有限公司18912101619
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
石家庄苏瑞化工有限公司15833970389 15833970389 · [email protected]
郑州鸿晟医药科技有限公司0371-55695890 15637198702 · [email protected]
重庆诺森医药有限公司15310618205 · [email protected]
Aladdin Scientific
Related reactions
47 records
Compound notes
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