Basic information
- CAS
53229-74-6- Standard SMILES
OCC1CCCC1OC1CCCCO1- InChIKey
VGPZOQUMOOQFOH-UHFFFAOYSA-N- Molecular formula
- C11H20O3
- Average molar mass
- 200.27 g/mol
- Monoisotopic mass
- 200.1412445
Names & identifiers
- Preferred name
- 2-((tetrahydro-2H-pyran-2-yl)oxy)-cyclopentanemethanol
- IUPAC
- [2-(oxan-2-yloxy)cyclopentyl]methanol
- English name
- Cyclopentanemethanol, 2-[(tetrahydro-2H-pyran-2-yl)oxy]- (9CI)
- Molecular formula
- C11H20O3
- Molecular weight
- 200.27
Names & synonyms
53229-74-62-[(Tetrahydro-2H-pyran-2-yl)oxy]-cyclopentanemethanol2-((tetrahydro-2H-pyran-2-yl)oxy)-cyclopentanemethanolRefChem:450162826-215-7[2-(oxan-2-yloxy)cyclopentyl]methanolCyclopentanemethanol, 2-[(tetrahydro-2H-pyran-2-yl)oxy]- (9CI)(2-((Tetrahydro-2H-pyran-2-yl)oxy)cyclopentyl)methanolstarbld0021776SCHEMBL2642478VGPZOQUMOOQFOH-UHFFFAOYSA-NDCA22974
Show more names
2-[(tetrahydro-2H-pyran-2-yl)oxy]CyclopentanemethanolCyclopentanemethanol, 2-[(tetrahydro-2H-pyran-2-yl)oxy]-
AKOS015900945DB-071648EN300-6473133[2-(tetrahydro-pyran-2-yloxy)-cyclopentyl]-methanol
Database identifiers
- CAS
53229-74-6- PubChem CID
- 21959040
- EC Number
- 826-215-7
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 172
Physicochemical properties
- Boiling point
- 312 · 312.0±27.0 °C(Predicted)
- Density
- 1.08 · 1.08±0.1 g/cm3(Predicted)
- pka
- 15.05 · 15.05±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H335-H315-H302
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+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%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H335-H315-H302
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers1 total
武汉艾瑞尔化学科技有限公司18986259541 18986259541 · [email protected]
Related reactions
4 records
Compound notes
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