Basic information
- Standard SMILES
O=C(Cl)C1CC1- InChIKey
ZOOSILUVXHVRJE-UHFFFAOYSA-N- Molecular formula
- C4H5ClO
- Average molar mass
- 104.53 g/mol
Names & identifiers
- Preferred name
- Cyclopropanecarbonyl chloride
- IUPAC
- cyclopropanecarbonyl chloride
- English name
- Cyclopropane-d5-carbonyl Chloride
- Molecular formula
- C4H5ClO
- Molecular weight
- 104.53
Names & synonyms
Show more names
Database identifiers
- CAS
1219794-96-3- UNII
- 6J5U4R2KAF
- EC Number
- 223-684-4
- Nikkaji
- J23.515F
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 75.6
Experimental & physicochemical properties
Safety & regulation
GHS classification
GHS Classification
Danger
H226 (86.3%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P234, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P363, P370+P378, P390, P403+P233, P403+P235, P405, P406, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 270 reports by companies from 12 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: Cyclopropanecarbonyl chloride
Status: Active Update: 12-10-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/11347
Cyclopropanecarboxylic acid chloride: Does not have an individual approval but may be used under an appropriate group standard
Chemistry & industry
Uses & manufacturing
Applications
UsesCyclopropane-1,2,2,3,3-d5-carbonyl chloride is a useful building block for organic synthesis
Suppliers7 total
Related reactions
No reaction records under the current filter.
Linked notes
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