1,1-Dimethoxy-cyclopentane

HCID 523052

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Basic information

CAS: 931-94-2
Standard SMILES: COC1(OC)CCCC1
InChIKey: AGWFDZMDKNQQHG-UHFFFAOYSA-N
Molecular formula: C7H14O2
Average molar mass: 130.18 g/mol
Monoisotopic mass: 130.09937969

Names & identifiers

Preferred name: 1,1-Dimethoxy-cyclopentane
IUPAC: 1,1-dimethoxycyclopentane
English name: 1,1-DIMETHOXYCYCLOPENTANE
Molecular formula: C7H14O2
Molecular weight: 130.18

Names & synonyms

1,1-dimethoxy-cyclopentaneRefChem:409931621-828-41,1-Dimethoxycyclopentane931-94-2MFCD00060058Cyclopentanone Dimethylketaldimethoxycyclopentanecyclopentanone dimethyl acetalSCHEMBL731782DTXSID80335145AKOS024428998

Show more names

1,1-DimethoxypentaneDimethoxypentaneCyclopentane, 1,1-dimethoxy-1,1-Dimethoxycyclopentane>CYCLOPENTANONE DIMETHYLKETAL1,1-DIMETHOXYCYCLOPENTANE ISO 9001：2015 REACH

BS-22655D1886T71471FT-0694286SCHEMBL5173939SCHEMBL5174492XH1253F801293

Database identifiers

CAS: 931-94-2
PubChem CID: 523052
DTXSID: DTXSID80335145
EC Number: 621-828-4
Nikkaji: J208.433C

Properties

Computed structural properties

XLogP: 1.1
Topological polar surface area: 18.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 9
Formal charge: 0
Complexity: 78

Physicochemical properties

Boiling point: 140 °C · 140 °C
Density: 0.95 · 0.95
refractive index: 1.424 · 1.4240-1.4300
form: clear liquid
color: Colorless to Almost colorless
Symbol(GHS): 2 · GHS02
Signal word: Danger
Hazard statements: 225 · H225
Precautionary statements: 210 · P210-P233-P240-P241+P242+P243-P280-P303+P361+P353-P370+P378-P403+P235-P501
Risk Statements: 11 · 11
Safety Statements: 9 · 9-16-33
RIDADR: 3271 · 3271
HazardClass: 3 · 3
PackingGroup: II
HS Code: 2909200090 · 2909200090

Safety & regulation

GHS classification

GHS Classification · 5 items

Danger

H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]；H302 (97.5%): Harmful if swallowed [Warning Acute toxicity, oral]；H318 (97.5%): Causes serious eye damage [Danger Serious eye damage/eye irritation]

P210, P233, P240, P241, P242, P243, P264, P264+P265, P270, P280, P301+P317, P303+P361+P353, P305+P354+P338, P317, P330, P370+P378, P403+P235, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；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

Hazard Classes and CategoriesFlam. Liq. 2 (100%)；Acute Tox. 4 (97.5%)；Eye Dam. 1 (97.5%)

Safety data

ridadr: 3271
hs_code: 2909200090
risk_code: 11
Signal word: Danger
Symbol(GHS): GHS02
safety_code: 9-16-33
hazard_class: 3
packing_group: II
Hazard statements: H225
Precautionary statements: P210-P233-P240-P241+P242+P243-P280-P303+P361+P353-P370+P378-P403+P235-P501