Spiro[adamantane-2,2'-oxirane]
Basic information
- CAS
24759-97-5- Standard SMILES
C1C2CC3CC1CC(C2)C31CO1- InChIKey
SVBWHNKBVYUWDJ-UHFFFAOYSA-N- Molecular formula
- C11H16O
- Average molar mass
- 164.24 g/mol
- Monoisotopic mass
- 164.12011513
Names & identifiers
- Preferred name
- Spiro[adamantane-2,2'-oxirane]
- IUPAC
- spiro[adamantane-2,2'-oxirane]
- English name
- 2-Epoxymethyleneadamantane
- Molecular formula
- C11H16O
- Molecular weight
- 164.24
Names & synonyms
spiro[adamantane-2,2'-oxirane]spiro(adamantane-2,2'-oxirane)RefChem:888703808-941-624759-97-5SPIRO[OXIRANE-2,2'-TRICYCLO[3.3.1.1~3,7~]DECANE]Spiro[oxirane-2,2'-tricyclo[3.3.1.13,7]decane]MFCD02683842Spiro[oxirane-2,2'-tricyclo[3.3.1.1(3,7)]decane]spiro(oxirane-2,2'-tricyclo(3.3.1.13,7)decane)NSC193487adamantane-2-spiro-2'-oxirane
Show more names
NSC 193487AKOS BC-0503ASISCHEM D51669CHEMBRDG-BB 4013916Adamantyleneoxirane2-Epoxymethyleneadamantane2-Methyleneadamantane epoxidespiro[oxirane-2，2'-tricyclo[3.3.1.1~3，7~]decane
SCHEMBL3054789DTXSID40307621SVBWHNKBVYUWDJ-UHFFFAOYSA-NZAA75997AKOS000425046AKOS006282082NSC-193487NCGC00665372-01
Database identifiers
- CAS
24759-97-5- PubChem CID
- 303804
- DTXSID
DTXSID40307621- EC Number
- 808-941-6
- Nikkaji
- J1.735.901K
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 205
Physicochemical properties
- Melting point
- 176 · 176-177℃ (methanol )
- Boiling point
- 238.9 · 238.9±8.0℃ (760 Torr)
- Density
- 1.13 · 1.13±0.1 g/cm3 (20 ºC 760 Torr)
- Flash point
- 75 · 75.0±15.3℃
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22
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, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- risk_code
- 22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
1 records
Compound notes
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