CAS 4606-07-9 Ethyl cyclopropanecarboxylate (HCID 78351)

Names & identifiers

Preferred name: Ethyl cyclopropanecarboxylate
IUPAC: ethyl cyclopropanecarboxylate
English name: Ethyl cyclopropanecarboxylate
Molecular formula: C6H10O2
Molecular weight: 114.14

Names & synonyms

Ethyl cyclopropanecarboxylate4606-07-9Ethyl cyclopropylcarboxylateCyclopropanecarboxylic acid, ethyl esterNSC 60696LDDOSDVZPSGLFZ-UHFFFAOYSA-DTXSID90196704EINECS 225-010-4Cyclopropanecarboxylic acid,ethyl esterRefChem:138907DTXCID90119195225-010-4

Show more names

RARECHEM AL BI 0553Monostearin Impurity 7Halofuginone Impurity 1CYCLOPROPYL ETHYL FORMATEETHYLCYCLOPROPANCARBOXYL.S(Ethoxycarbonyl)cyclopropane

InChI=1/C6H10O2/c1-2-8-6(7)5-3-4-5/h5H,2-4H2,1H3LDDOSDVZPSGLFZ-UHFFFAOYSA-NCyclopropanecarboxylic acid ethyl esterMFCD00001282EthylcyclopropanecarboxylateEthyl cyclopropane carboxylateNSC-60696NSC60696

Database identifiers

CAS: 4606-07-9
PubChem CID: 78351
DTXSID: DTXSID90196704
UNII: HQ5TVT5MWG
EC Number: 225-010-4
Nikkaji: J149.988B

Properties

Computed structural properties

XLogP: 0.9
Topological polar surface area: 26.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 8
Formal charge: 0
Complexity: 94

Physicochemical properties

Boiling point: 129 · 129-133 °C (lit.)
Density: 0.96 g/mL · 0.96 g/mL at 25 °C (lit.)
refractive index: 20 · n20/D 1.420(lit.)
Flash point: 65 °F · 65 °F
storage temp.: 2 · Sealed in dry,2-8°C
solubility: Chloroform, Methanol (Slightly)
form: Liquid
color: Clear pale yellow
PH: 7 · 7 (H2O)
Water Solubility: immiscible
BRN: 2039752 · 2039752
InChI: InChI=1S/C6H10O2/c1-2-8-6(7)5-3-4-5/h5H,2-4H2,1H3
InChIKey: LDDOSDVZPSGLFZ-UHFFFAOYSA-N
SMILES: C1(C(OCC)=O)CC1
CAS DataBase Reference: 4606 · 4606-07-9(CAS DataBase Reference)
NIST Chemistry Reference: Ethyl cyclopropanecarboxylate(4606-07-9)
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 2 · GHS02
Signal word: Danger
Hazard statements: 225 · H225
Precautionary statements: 210 · P210
PPE: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Hazard Codes: F
Risk Statements: 11 · 11
Safety Statements: 16 · 16
RIDADR: 3272 · UN 3272 3/PG 2
WGK Germany: 3 · 3
Hazard Note: Highly Flammable
HazardClass: 3 · 3
PackingGroup: II
HS Code: 29162000 · 29162000
Storage Class: 3 · 3 - Flammable liquids
Hazard Classifications: 2 · Flam. Liq. 2
REACH Registrations: Active
Limited Quantities: 1 L · 1.0 L (0.3 gallon) (liquid)
Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)

Safety & regulation

GHS classification

GHS Classification · 5 items

Danger

H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 47 reports by companies from 2 notifications to the ECHA C&L Inventory.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Regulatory Information · 3 items

Chemical: Cyclopropanecarboxylic acid, ethyl ester

Status: Active Update: 07-03-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/23655

Ethyl cyclopropanecarboxylate: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesFlam. Liq. 2 (100%)

Regulatory information

Regulatory Information · 3 items

Chemical: Cyclopropanecarboxylic acid, ethyl ester

Status: Active Update: 07-03-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/23655

Ethyl cyclopropanecarboxylate: Does not have an individual approval but may be used under an appropriate group standard

Safety data

PPE: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
wgk: 3
ridadr: UN 3272 3/PG 2
hs_code: 29162000
risk_code: 11
Signal word: Danger
Symbol(GHS): GHS02
hazard_code: F
hazard_note: Highly Flammable
safety_code: 16
hazard_class: 3
Storage Class: 3 - Flammable liquids
packing_group: II
Hazard statements: H225
Limited Quantities: 1.0 L (0.3 gallon) (liquid)
Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
REACH Registrations: Active
Hazard Classifications: Flam. Liq. 2
Precautionary statements: P210

Chemistry & industry

Applications

UsesEthyl cyclopropanecarboxylate is a reagent used in the addition of cyclopropane. It acts as annulation reagent for the conversion of aromatics to 2-methylindanones under Friedel-Crafts conditions.

UsesEthyl cyclopropanecarboxylate is a reagent used in the addition of cyclopropane.