Spiro(cyclohexane-1,2'-benzimidazoline)
Basic information
- CAS
3190-03-2- Standard SMILES
c1ccc2c(c1)NC1(CCCCC1)N2- InChIKey
YWEQCYWQCBWFMN-UHFFFAOYSA-N- Molecular formula
- C12H16N2
- Average molar mass
- 188.27 g/mol
- Monoisotopic mass
- 188.13134852
Names & identifiers
- Preferred name
- Spiro(cyclohexane-1,2'-benzimidazoline)
- IUPAC
- spiro[1,3-dihydrobenzimidazole-2,1'-cyclohexane]
- English name
- Spiro[3-azaindoline-2,1'-cyclohexane]
- Molecular formula
- C12H16N2
- Molecular weight
- 188.27
Names & synonyms
SPIRO(CYCLOHEXANE-1,2'-BENZIMIDAZOLINE)RefChem:888739667-481-23190-03-21,3-Dihydrospiro[benzo[d]imidazole-2,1'-cyclohexane]SPIRO[3-AZAINDOLINE-2,1'-CYCLOHEXANE]1,3-dihydrospiro[1,3-benzodiazole-2,1'-cyclohexane]spiro[1,3-dihydrobenzimidazole-2,1'-cyclohexane]MFCD00089091Oprea1_257783SCHEMBL8655732DTXSID401346489
Show more names
AKOS 903161,3-dihydrospiro[2H-benzimidazole-2,1'-cyclohexane]1,3-Dihydrospiro[benzo[d]imidazole-2,1'-cyclohexane
AKOS000279522MS-99701,3-dihydrobenzimidazole-2-spirocyclohexane2,3-dihydrobenzimidazole-2-spirocyclohexane1,3-dihydrospiro[benzimidazole-2,1'-cyclohexane]1,3aDihydrospiro[1,3abenzodiazolea2,1'a cyclohexane]Spiro[2H-benzimidazole-2,1'-cyclohexane], 1,3-dihydro-
Database identifiers
- CAS
3190-03-2- PubChem CID
- 708581
- DTXSID
DTXSID401346489- EC Number
- 667-481-2
- Nikkaji
- J555.102A
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 24.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 192
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 411 · H411-H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
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, P273, P301+P317, P330, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 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
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- Hazard statements
- H411-H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Suppliers
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Related reactions
2 records
Compound notes
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