Dicyclopentadiene ketone
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Basic information
- CAS
6316-16-1- Standard SMILES
O=C1CC2CC1C1C=CCC21- InChIKey
UCWKJFXRPXCVCD-UHFFFAOYSA-N- Molecular formula
- C10H12O
- Average molar mass
- 148.2 g/mol
- Monoisotopic mass
- 148.088815
Names & identifiers
- Preferred name
- Dicyclopentadiene ketone
- IUPAC
- tricyclo[5.2.1.02,6]dec-4-en-8-one
- English name
- 1,3a,4,6,7,7a-hexahydro-4,7-methano-5H-inden-5-one
- Molecular formula
- C10H12O
- Molecular weight
- 148.2
Names & synonyms
6316-16-1Dicyclopentadiene ketone4,7-Methano-5H-inden-5-one, 1,3a,4,6,7,7a-hexahydro-NSC 224581,3a,4,6,7,7a-Hexahydro-4,7-methano-5H-inden-5-oneEINECS 228-649-7NSC 31987Tricyclo(5.2.1.02,6)dec-4-en-8-oneDTXSID10863744Tricyclo[5.2.1.02,6]dec-4-en-8-oneRefChem:586894DTXCID60812323
Show more names
8-KETOTRICYCLO(5.2.1.0 2,6)-4-DECENE
228-649-7tricyclo[5.2.1.0,2,6]dec-4-en-8-one3A,4,7,7a-tetrahydro-1H-4,7-methanoinden-5(6H)-one4, 1,3a,4,6,7,7a-hexahydro-Tricyclo[5.2.1.0(2,6)]dec-4-en-8-oneSCHEMBL5696189NSC22458NSC31987
Database identifiers
- CAS
6316-16-1- PubChem CID
- 95184
- DTXSID
DTXSID10863744- EC Number
- 228-649-7
- Nikkaji
- J206.905I
Properties
Computed structural propertiesFilling in
- XLogP
- 1.3
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 241
Physicochemical properties
- LogP
- 0.888 · 0.888 (est)
- EPA Substance Registry System
- 4 · 4,7-Methano-5H-inden-5-one, 1,3a,4,6,7,7a-hexahydro- (6316-16-1)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P
- 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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Uses & manufacturing
General Manufacturing Information4,7-Methano-5H-inden-5-one, 1,3a,4,6,7,7a-hexahydro-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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