3-(2,3-dihydro-1H-inden-5-yl)propan-1-ol
Basic information
- CAS
56635-78-0- Standard SMILES
OCCCc1ccc2c(c1)CCC2- InChIKey
AFPDTRFNRJNPSI-UHFFFAOYSA-N- Molecular formula
- C12H16O
- Average molar mass
- 176.25 g/mol
- Monoisotopic mass
- 176.12011513
Names & identifiers
- Preferred name
- 3-(2,3-dihydro-1H-inden-5-yl)propan-1-ol
- IUPAC
- 3-(2,3-dihydro-1H-inden-5-yl)propan-1-ol
Names & synonyms
3-(2,3-dihydro-1H-inden-5-yl)propan-1-ol56635-78-0RefChem:489990829-098-03-(5-Indanyl)-1-propanolSCHEMBL81351GCA63578AKOS013465148EN300-1634437
Database identifiers
- CAS
56635-78-0- PubChem CID
- 12646172
- EC Number
- 829-098-0
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 155
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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 CategoriesSkin Irrit. 2 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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