(2,3-dihydro-1H-inden-5-yl)methanol

HCID 330183

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Basic information

CAS: 51632-06-5
Standard SMILES: OCc1ccc2c(c1)CCC2
InChIKey: SJKGAFDWIVOCSE-UHFFFAOYSA-N
Molecular formula: C10H12O
Average molar mass: 148.2 g/mol
Monoisotopic mass: 148.088815

Names & identifiers

Preferred name: (2,3-dihydro-1H-inden-5-yl)methanol
IUPAC: 2,3-dihydro-1H-inden-5-ylmethanol
English name: 5-Hydroxymethylindane
Molecular formula: C10H12O
Molecular weight: 148.2

Names & synonyms

(2,3-dihydro-1H-inden-5-yl)methanolRefChem:394513988-537-55-Hydroxymethylindane51632-06-5Indan-5-yl-methanol2,3-dihydro-1H-inden-5-ylmethanolMFCD04038655indan-5-ylmethanol5-HydroxymethyLindanNSC317014(5-Indanyl)methanol

Show more names

5-(hydroxymethyl)indaneSCHEMBL1465705DTXSID70317495SJKGAFDWIVOCSE-UHFFFAOYSA-NBCA632062,3-Dihydro-1H-indene-5-methanolAKOS0093335311H-Indene-5-methanol, 2,3-dihydro-

Database identifiers

CAS: 51632-06-5
PubChem CID: 330183
DTXSID: DTXSID70317495
EC Number: 988-537-5

Properties

Computed structural properties

XLogP: 1.9
Topological polar surface area: 20.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 11
Formal charge: 0
Complexity: 133

Physicochemical properties

Melting point: 73.5 · 73.5-74.5 °C(Solv: benzene (71-43-2); ligroine (8032-32-4))
Boiling point: 277.7 · 277.7±9.0 °C(Predicted)
Density: 1.119 · 1.119±0.06 g/cm3(Predicted)
pka: 14.5 · 14.50±0.10(Predicted)

Safety & regulation

GHS classification

GHS Classification · 4 items

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.