2-(Benzylamino)-2-cyclopropylethan-1-ol
Basic information
- CAS
776315-65-2- Standard SMILES
OCC(NCc1ccccc1)C1CC1- InChIKey
DZDKMEPDTJSHHN-UHFFFAOYSA-N- Molecular formula
- C12H17NO
- Average molar mass
- 191.27 g/mol
- Monoisotopic mass
- 191.13101417
Names & identifiers
- Preferred name
- 2-(Benzylamino)-2-cyclopropylethan-1-ol
- IUPAC
- 2-(benzylamino)-2-cyclopropylethanol
- English name
- 2-(benzylamino)-2-cyclopropylethanol
- Molecular formula
- C12H17NO
- Molecular weight
- 191.26948
Names & synonyms
2-(benzylamino)-2-cyclopropylethan-1-ol776315-65-2RefChem:459727870-810-42-(benzylamino)-2-cyclopropylethanolBGB31565AKOS010564734DA-27880EN300-117623G88011F8889-6441Z802856366
Show more names
Cyclopropaneethanol, β-[(phenylmethyl)amino]-
Database identifiers
- CAS
776315-65-2- PubChem CID
- 61310753
- EC Number
- 870-810-4
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 162
Physicochemical properties
- Boiling point
- 337.4 · 337.4±17.0 °C(Predicted)
- Density
- 1.109 · 1.109±0.06 g/cm3(Predicted)
- pka
- 14.55 · 14.55±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 318 · H318-H335-H315
- Precautionary statements
- 280 · P280-P305+P351+P338-P310-P264-P280-P302+P352-P321-P332+P313-P362
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
Danger
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H318-H335-H315
- Precautionary statements
- P280-P305+P351+P338-P310-P264-P280-P302+P352-P321-P332+P313-P362
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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