Ethyl cyclohexylideneacetate

HCID 73776

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Basic information

CAS: 1552-92-7
Standard SMILES: CCOC(=O)C=C1CCCCC1
InChIKey: MCWDXHYYYNGYGK-UHFFFAOYSA-N
Molecular formula: C10H16O2
Average molar mass: 168.23 g/mol
Monoisotopic mass: 168.11502975

Names & identifiers

Preferred name: Ethyl cyclohexylideneacetate
IUPAC: ethyl 2-cyclohexylideneacetate
English name: ETHYL CYCLOHEXYLIDENEACETATE
Molecular formula: C10H16O2
Molecular weight: 168.23

Names & synonyms

1552-92-7Ethyl cyclohexylideneacetateAcetic acid, 2-cyclohexylidene-, ethyl esterFEJ212C272EINECS 216-297-7NSC 18981NSC-18981DTXSID10165856RefChem:596165DTXCID4088347216-297-7ethyl 2-cyclohexylideneacetate

Show more names

Ethyl cyclohexylideneacetate,98%ethyl 2-cyclohexylideneethanoate2-isocyclohexylacetic acidethyl esterΔ1,α-Cyclohexaneacetic Acid Ethyl Ester2-Cyclohexylideneacetic acid ethyl ester

ethyl 2-cyclohexylidenacetateCyclohexylideneacetic Acid Ethyl EsterAcetic acid, cyclohexylidene-, ethyl ester2-Cyclohexylidene-acetic Acid Ethyl EsterEthoxycarbonylmethylenecyclohexaneMFCD00963857.DELTA.1,.alpha.-Cyclohexaneacetic acid, ethyl esterCyclohexylideneacetic acid ethyl

Database identifiers

CAS: 1552-92-7
PubChem CID: 73776
DTXSID: DTXSID10165856
UNII: FEJ212C272
EC Number: 216-297-7
Nikkaji: J80.227A

Properties

Computed structural properties

XLogP: 2.5
Topological polar surface area: 26.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 12
Formal charge: 0
Complexity: 174

Physicochemical properties

Boiling point: 48 · 48-49°C/0.02mm
Density: 1.05 · 1.050
Flash point: 48 · 48-49°C/0.02mm
storage temp.: Sealed in dry,Room Temperature
solubility: Soluble in dichloromethane, ethyl acetate.
form: Clear Liquid
Appearance: Colorless to light yellow Liquid
CAS DataBase Reference: 1552 · 1552-92-7
FDA UNII: 212 C272 · FEJ212C272
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 319 · H319-H315-H335-H302
Precautionary statements: 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26-36
HazardClass: IRRITANT
HS Code: 2916200090 · 2916200090

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

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%)

Safety data

hs_code: 2916200090
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
safety_code: 26-36
hazard_class: IRRITANT
Hazard statements: H319-H315-H335-H302
Precautionary statements: P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P