(-)-cis-(Pinan-2-ylmethyl)amine
Basic information
- CAS
38235-68-6- Standard SMILES
CC1(C)[C@@H]2CC[C@@H](CN)[C@H]1C2- InChIKey
SYJBFPCQIJQYNV-DJLDLDEBSA-N- Molecular formula
- C10H19N
- Average molar mass
- 153.26 g/mol
- Monoisotopic mass
- 153.15174961
Names & identifiers
- Preferred name
- (-)-cis-(Pinan-2-ylmethyl)amine
- IUPAC
- [(1R,2R,5R)-6,6-dimethyl-2-bicyclo[3.1.1]heptanyl]methanamine
Names & synonyms
52580-60-6Myrtanylamine, trans-(+/-)-V7F8W23LY9(-)-cis-(Pinan-2-ylmethyl)amine38235-68-6[(1R,4R,5R)-6,6-dimethyl-4-bicyclo[3.1.1]heptanyl]methanamineUNII-V7F8W23LY9SCHEMBL1250842SYJBFPCQIJQYNV-DJLDLDEBSA-NDTXSID301174392EINECS 258-018-1Rel-((1R,2R,5R)-6,6-dimethylbicyclo[3.1.1]heptan-2-yl)methanamine
Show more names
AKOS015894827[(1R,2R,5R)-6,6-dimethyl-2-bicyclo[3.1.1]heptanyl]methanamine1-[(1R,2R,5R)-6,6-DIMETHYLBICYCLO[3.1.1]HEPTAN-2-YL]METHANAMINEBicyclo[3.1.1]heptane-2-methanamine, 6,6-dimethyl-, (1I+/-,2I+/-,5I+/-)-
Database identifiers
- CAS
38235-68-6、52580-60-6- PubChem CID
- 104241
- DTXSID
DTXSID301174392- EC Number
- 258-018-1
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 162
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 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, 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. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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