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Ethyl 1-(2,2-dimethylpropanoyl)cyclopropane-1-carboxylate

HCID 79554604
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Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
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Basic information

CAS
1520602-41-8
Standard SMILES
CCOC(=O)C1(C(=O)C(C)(C)C)CC1
InChIKey
HPORWKOQHOKMSC-UHFFFAOYSA-N
Molecular formula
C11H18O3
Average molar mass
198.26 g/mol
Monoisotopic mass
198.12559443

Names & identifiers

Preferred name
Ethyl 1-(2,2-dimethylpropanoyl)cyclopropane-1-carboxylate
IUPAC
ethyl 1-(2,2-dimethylpropanoyl)cyclopropane-1-carboxylate

Names & synonyms

1520602-41-8ethyl 1-(2,2-dimethylpropanoyl)cyclopropane-1-carboxylateEthyl 1-pivaloylcyclopropane-1-carboxylateethyl1-(2,2-dimethylpropanoyl)cyclopropane-1-carboxylateAKOS018110513EN300-2028413

Database identifiers

CAS
1520602-41-8
PubChem CID
79554604
EC Number
170-356-0

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
43.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
14
Formal charge
0
Complexity
256

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

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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 CategoriesSkin Irrit. 2 (100%)

Related reactions

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Compound notes

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