2-chloro-1-(2,3-dihydro-1H-inden-5-yl)propan-1-one
Basic information
- CAS
885460-84-4- Standard SMILES
CC(Cl)C(=O)c1ccc2c(c1)CCC2- InChIKey
CQOVKKPNERBRNR-UHFFFAOYSA-N- Molecular formula
- C12H13ClO
- Average molar mass
- 208.68 g/mol
- Monoisotopic mass
- 208.0654927
Names & identifiers
- Preferred name
- 2-chloro-1-(2,3-dihydro-1H-inden-5-yl)propan-1-one
- IUPAC
- 2-chloro-1-(2,3-dihydro-1H-inden-5-yl)propan-1-one
- English name
- 1-Propanone, 2-chloro-1-(2,3-dihydro-1H-inden-5-yl)-
- Molecular formula
- C12H13ClO
- Molecular weight
- 208.68
Names & synonyms
2-chloro-1-(2,3-dihydro-1H-inden-5-yl)propan-1-one885460-84-4RefChem:468291107-698-72-chloro-1-indan-5-yl-propan-1-oneAKOS009031232CS-0231784EN300-10999G38857Z1044927481-Propanone, 2-chloro-1-(2,3-dihydro-1H-inden-5-yl)-
Database identifiers
- CAS
885460-84-4- PubChem CID
- 4868359
- EC Number
- 107-698-7
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 226
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Suppliers
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Related reactions
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Compound notes
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