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(Prop-2-yn-1-yloxy)cyclopentane

HCID 85577433
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Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
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Basic information

CAS
118464-10-1
Standard SMILES
C#CCOC1CCCC1
InChIKey
JAVNRYFPBGCMOC-UHFFFAOYSA-N
Molecular formula
C8H12O
Average molar mass
124.18 g/mol
Monoisotopic mass
124.088815

Names & identifiers

Preferred name
(Prop-2-yn-1-yloxy)cyclopentane
IUPAC
prop-2-ynoxycyclopentane

Names & synonyms

(prop-2-yn-1-yloxy)cyclopentane118464-10-1RefChem:406887972-410-6prop-2-ynoxycyclopentanecyclopentylpropargyl etherSCHEMBL1513752SCHEMBL3633268JAVNRYFPBGCMOC-UHFFFAOYSA-NAKOS026718956DB-110637G28714
Show more names
F2167-2803

Database identifiers

CAS
118464-10-1
PubChem CID
85577433
EC Number
972-410-6

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
9.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
9
Formal charge
0
Complexity
114

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 · 4 items

Warning

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, 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 CategoriesFlam. Liq. 3 (100%)

Related reactions

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New reaction record

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Compound notes

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