5-Chloro-2-methyl-2,3-dihydro-1H-inden-1-one
Basic information
- CAS
64220-40-2- Standard SMILES
CC1Cc2cc(Cl)ccc2C1=O- InChIKey
RNMXBENXOQYACE-UHFFFAOYSA-N- Molecular formula
- C10H9ClO
- Average molar mass
- 180.63 g/mol
- Monoisotopic mass
- 180.03419259
Names & identifiers
- Preferred name
- 5-Chloro-2-methyl-2,3-dihydro-1H-inden-1-one
- IUPAC
- 5-chloro-2-methyl-2,3-dihydroinden-1-one
- English name
- 5-chloro-2-methyl-1-indanone
- Molecular formula
- C10H9ClO
- Molecular weight
- 180.63
Names & synonyms
5-Chloro-2-methyl-2,3-dihydro-1H-inden-1-one64220-40-2DTXSID90621329RefChem:302429DTXCID305720835-chloro-2-methyl-1-indanone5-CHLORO-2-METHYL-2,3-DIHYDROINDEN-1-ONEMFCD131521281H-Inden-1-one, 5-chloro-2,3-dihydro-2-methyl-5-Chloro-2-methylindan-1-oneSCHEMBL6248819SCHEMBL29404958
Show more names
1H-Inden-1-one, 5-chloro-2,3-dihydro-2-methyl
5-chloro-2-methyl-indan-1-oneRNMXBENXOQYACE-UHFFFAOYSA-NAKOS022173375DS-7285SY115064DB-332901CS-01387695-Chloro-2-methyl-23-dihydro-1H-inden-1-one
Database identifiers
- CAS
64220-40-2- PubChem CID
- 21995614
- DTXSID
DTXSID90621329
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 202
Physicochemical properties
- storage temp.
- Sealed in dry,Room Temperature
- Appearance
- Off-white to yellow Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312+H332-H315-H319-H335
- Precautionary statements
- 261 · P261-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.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302+H312+H332-H315-H319-H335
- Precautionary statements
- P261-P280-P305+P351+P338
Related reactions
4 records
Compound notes
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