CAS 66692-75-9 Ethyl 3-formyl-2,2-dimethylcyclopropane-1-carboxylate (HCID 566079)

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Basic information

CAS: 66692-75-9
Standard SMILES: CCOC(=O)C1C(C=O)C1(C)C
InChIKey: ZFZXRNVTYVRULM-UHFFFAOYSA-N
Molecular formula: C9H14O3
Average molar mass: 170.21 g/mol
Monoisotopic mass: 170.09429431

Names & identifiers

Preferred name: Ethyl 3-formyl-2,2-dimethylcyclopropane-1-carboxylate
IUPAC: ethyl 3-formyl-2,2-dimethylcyclopropane-1-carboxylate
English name: Cyclopropanecarboxylic acid, 3-formyl-2,2-dimethyl-, ethyl ester
Molecular formula: C9H14O3
Molecular weight: 170.21

Names & synonyms

ethyl 3-formyl-2,2-dimethylcyclopropane-1-carboxylateRefChem:594958895-517-966692-75-9Ethyl 3-formyl-2,2-dimethylcyclopropanecarboxylatecaronaldehydeMFCD11500113SCHEMBL358792DTXSID70340607Cyclopropanecarboxylic acid, 3-formyl-2,2-dimethyl-, ethyl esterRCA69275AKOS006324572

Show more names

DB-171230EN300-131568ethyl 2,2-dimethyl-3-formylcyclopropanecarboxylateethyl 2-formyl-3,3-dimethylcyclopropanecarboxylateEthyl 3-formyl-2,2-dimethylcyclopropanecarboxylate #ethyl3-formyl-2,2-dimethylcyclopropane-1-carboxylateZ11983214162,2-dimethyl-3-formyl-cyclopropanecarboxylic acid ethyl ester

Database identifiers

CAS: 66692-75-9
PubChem CID: 566079
DTXSID: DTXSID70340607
EC Number: 895-517-9

Properties

Computed structural properties

XLogP: 0.9
Topological polar surface area: 43.4 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 4
Heavy atoms: 12
Formal charge: 0
Complexity: 208

Physicochemical properties

Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 280 · P280-P305+P351+P338

Safety & regulation

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.