Tetrahydrofuran-3-carbonyl chloride

HCID 14020412CAS 69595-02-4

Substructure search Find similar structures

Basic information

Standard SMILES: O=C(Cl)C1CCOC1
InChIKey: RVMFDSHMPBPWRK-UHFFFAOYSA-N
Molecular formula: C5H7ClO2
Average molar mass: 134.56 g/mol
Monoisotopic mass: 134.0134572

Names & identifiers

Preferred name: Tetrahydrofuran-3-carbonyl chloride
IUPAC: oxolane-3-carbonyl chloride
English name: Tetrahydro-furan-3-carbonyl chloride
Molecular formula: C5H7ClO2
Molecular weight: 134.56

Names & synonyms

Tetrahydrofuran-3-carbonyl chlorideRefChem:897170692-545-169595-02-4oxolane-3-carbonyl chlorideTETRAHYDRO-FURAN-3-CARBONYL CHLORIDEMFCD066566963-(Chlorocarbonyl)tetrahydrofuran, 3-(chloroformyl)tetrahydrofuran3-tetrahydrofuroyl chlorideSCHEMBL231691DTXSID80554394RVMFDSHMPBPWRK-UHFFFAOYSA-N

Show more names

Tetrahydrofuran-3-carbonylchlorideUCA59502GEO-03833SBB0858763-Furancarbonyl chloride, tetrahydro-AKOS010530772(+/-) tetrahydro-3-furoic acid chloridePS-10940

Database identifiers

CAS: 69595-02-4
PubChem CID: 14020412
DTXSID: DTXSID80554394
EC Number: 692-545-1

Properties

Computed structural properties

XLogP: 0.7
Topological polar surface area: 26.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 8
Formal charge: 0
Complexity: 103

Physicochemical properties

Boiling point: 172.8 · 172.8±33.0 °C(Predicted)
Density: 1.27 · 1.270±0.06 g/cm3(Predicted)
Symbol(GHS): 5 · GHS05,GHS07
Signal word: Danger
Hazard statements: 302 · H302-H314-H318
Precautionary statements: 280 · P280-P301+P312-P303+P361+P353-P304+P340-P305+P351+P338-P310
HS Code: 2932190090 · 2932190090

Safety & regulation

GHS classification

GHS Classification · 5 items

Danger

H302 (66.7%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (33.3%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H318 (33.3%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H332 (33.3%): Harmful if inhaled [Warning Acute toxicity, inhalation]

P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 3 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 CategoriesAcute Tox. 4 (66.7%)；Acute Tox. 4 (33.3%)；Skin Corr. 1B (100%)；Eye Dam. 1 (33.3%)；Acute Tox. 4 (33.3%)

Safety data

hs_code: 2932190090
Signal word: Danger
Symbol(GHS): GHS05,GHS07
Hazard statements: H302-H314-H318
Precautionary statements: P280-P301+P312-P303+P361+P353-P304+P340-P305+P351+P338-P310