CAS 60472-29-9 4,7-Methano-1H-inden-5-ol, octahydro-5-(2-propen-1-yl)- (HCID 108464)

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Basic information

CAS: 60472-29-9
Standard SMILES: C=CCC1(O)CC2CC1C1CCCC21
InChIKey: RFMGDEQGIOAYPI-UHFFFAOYSA-N
Molecular formula: C13H20O
Average molar mass: 192.3 g/mol
Monoisotopic mass: 192.15141526

Names & identifiers

Preferred name: 4,7-Methano-1H-inden-5-ol, octahydro-5-(2-propen-1-yl)-
IUPAC: 8-prop-2-enyltricyclo[5.2.1.02,6]decan-8-ol
English name: 5-allyl-octahydro-4,7-methano-1H-inden-5-ol
Molecular formula: C13H20O
Molecular weight: 192.3

Names & synonyms

EINECS 262-254-04,7-Methano-1H-inden-5-ol, octahydro-5-(2-propenyl)-4,7-Methano-1H-inden-5-ol, octahydro-5-(2-propen-1-yl)-DTXSID408864015-(2-Propenyl)octahydro-4,7-methano-1H-inden-5-olRefChem:508276DTXCID7010257315-Allyl-octahydro-4,7-methano-1H-inden-5-ol60472-29-9SCHEMBL7574643AKOS018291583DB-317136

Show more names

Octahydro-5-(2-propenyl)-4,7-methano-1H-inden-5-ol47-Methano-1H-Inden-5-0Loctahydro-5-(2Propen-1-Yl)-:47-Methano-1H-Inden-5-Olocta

NS000559348-allyl-8-hydroxytricyclo [5,2,1,02,6 ] decane5-(Prop-2-en-1-yl)octahydro-1H-4,7-methanoinden-5-ol

Database identifiers

CAS: 60472-29-9
PubChem CID: 108464
DTXSID: DTXSID40886401
EC Number: 262-254-0
Nikkaji: J268.204D

Properties

Computed structural properties

XLogP: 3.2
Topological polar surface area: 20.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 2
Heavy atoms: 14
Formal charge: 0
Complexity: 260

Physicochemical properties

Boiling point: 271.1 · 271.1±9.0 °C(Predicted)
Density: 1.044 · 1.044±0.06 g/cm3(Predicted)
pka: 14.93 · 14.93±0.20(Predicted)
EPA Substance Registry System: 4 · 4,7-Methano-1H-inden-5-ol, octahydro-5-(2-propenyl)- (60472-29-9)
TSCA: TSCA listed