Basic information
- CAS
2279-18-7- Standard SMILES
C=CCOC1CC2CC1C1C=CCC21- InChIKey
QFRXRJATKANZGZ-UHFFFAOYSA-N- Molecular formula
- C13H18O
- Average molar mass
- 190.28 g/mol
- Monoisotopic mass
- 190.13576519
Names & identifiers
- Preferred name
- 3a,4,5,6,7,7a-Hexahydro-5(or 6)(2-propen-1-yloxy)-4,7-methano-1H-indene
- IUPAC
- 9-prop-2-enoxytricyclo[5.2.1.02,6]dec-3-ene
- English name
- 5-(allyloxy)-3a,4,5,6,7,7a-hexahydro-4,7-methano-1H-indene
- Molecular formula
- C13H18O
- Molecular weight
- 190.28142
Names & synonyms
26912-64-14,7-Methano-1H-indene, 3a,4,5,6,7,7a-hexahydro-5(or 6)(2-propen-1-yloxy)-9-(2-Propenyloxy)tricyclo(5.2.1.0(2,6))dec-3(or-4-)-eneRefChem:505527DTXSID3010729303a,4,5,6,7,7a-Hexahydro-5(or 6)(2-propen-1-yloxy)-4,7-methano-1H-indene430-830-22279-18-74,7-Methano-1H-indene, 3a,4,5,6,7,7a-hexahydro-5-(2-propenyloxy)-5-(Allyloxy)-3a,4,5,6,7,7a-hexahydro-4,7-methano-1H-indene4,7-Methano-1H-indene, 3a,4,5,6,7,7a-hexahydro-5(or 6)-(2-propenyloxy)-4,7-Methano-1H-indene, 3a,4,5,6,7,7a-hexahydro-5-(2-propen-1-yloxy)-
Show more names
3a,4,5,6,7,7a-Hexahydro-5-(2-propenyloxy)-4,7-methano-1H-indene
EINECS 218-908-2EC 430-830-2Hexahydro-4,7-methanoinden-5(or 6)-propenyl etherSCHEMBL3504651DTXSID30865326QFRXRJATKANZGZ-UHFFFAOYSA-NNS000036015-[(Prop-2-en-1-yl)oxy]-3a,4,5,6,7,7a-hexahydro-1H-4,7-methanoindene
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 268
Physicochemical properties
- EPA Substance Registry System
- 4 · 4,7-Methano-1H-indene, 3a,4,5,6,7,7a-hexahydro-5-(2-propenyloxy)- (2279-18-7)
- TSCA
- TSCA listed
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: Causes skin irritation [Warning Skin corrosion/irritation]
P264, P273, P280, P302+P352, P321, P332+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P273, P280, P302+P352, P321, P332+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Hazard information
Regulatory Information
Chemical: Ether, allyl 3a,4,5,6,7,7a-hexahydro-4,7-methanoinden-5(or 6)-yl
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
REACH registered substance: 9-(2-propenyloxy)tricyclo[5.2.1.0(2,6)]dec-3(or-4-)-ene (EC: 430-830-2)
Hazard Classes and Categories
Skin Irrit. 2 (100%)
Skin irritation - category 2
Skin Irrit. 2
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information
4,7-Methano-1H-indene, 3a,4,5,6,7,7a-hexahydro-5-(2-propen-1-yloxy)-: INACTIVE
4,7-Methano-1H-indene, 3a,4,5,6,7,7a-hexahydro-5(or 6)(2-propen-1-yloxy)-: INACTIVE
Suppliers1 total
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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