Basic information
- CAS
7699-50-5- Standard SMILES
OCCCC1CCCN1- InChIKey
JAAFQZNROQTUIW-UHFFFAOYSA-N- Molecular formula
- C7H15NO
- Average molar mass
- 129.2 g/mol
- Monoisotopic mass
- 129.1153641
Names & identifiers
- Preferred name
- 3-(Pyrrolidin-2-yl)propan-1-ol
- IUPAC
- 3-pyrrolidin-2-ylpropan-1-ol
- English name
- 3-Pyrrolidin-2-yl-propan-1-ol
- Molecular formula
- C7H15NO
- Molecular weight
- 129.2
Names & synonyms
3-(pyrrolidin-2-yl)propan-1-ol7699-50-5DTXSID80515682RefChem:275971DTXCID40466489817-566-73-Pyrrolidin-2-yl-propan-1-ol3-pyrrolidin-2-ylpropan-1-ol2-Pyrrolidinepropanol3-(2-pyrrolidinyl)propanolSCHEMBL1098109SCHEMBL1098112
Show more names
SCHEMBL5118144JAAFQZNROQTUIW-UHFFFAOYSA-NHAA69950MFCD09757457AKOS011652976NCGC00340928-01(+/-)-3-(2-pyrrolidinyl)-1-propanolEN300-62211
Database identifiers
- CAS
7699-50-5- PubChem CID
- 13029331
- DTXSID
DTXSID80515682- EC Number
- 817-566-7
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 75.3
Physicochemical properties
- Boiling point
- 80 · 80-81 °C(Press: 1 Torr)
- Density
- 0.947 · 0.947±0.06 g/cm3(Predicted)
- pka
- 15.13 · 15.13±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H335-H315
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-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
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)
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
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H335-H315
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Suppliers4 total
海济医药科技（苏州）有限公司18012778619 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
江苏药泽医药科技有限公司18550739526 · [email protected]
Related reactions
1 records
Compound notes
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