3-(Azetidin-1-yl)propan-1-ol
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Basic information
- CAS
925903-31-7- Standard SMILES
OCCCN1CCC1- InChIKey
FUEPSWDWSHCZHJ-UHFFFAOYSA-N- Molecular formula
- C6H13NO
- Average molar mass
- 115.17 g/mol
Names & identifiers
- Preferred name
- 3-(Azetidin-1-yl)propan-1-ol
- IUPAC
- 3-(azetidin-1-yl)propan-1-ol
- English name
- 1-Azetidinepropanol
- Molecular formula
- C6H13NO
- Molecular weight
- 115.17
Names & synonyms
3-(azetidin-1-yl)propan-1-ol925903-31-7RefChem:494191826-113-21-AzetidinepropanolMFCD09751767SCHEMBL1662583SCHEMBL3427016SCHEMBL9614993FUEPSWDWSHCZHJ-UHFFFAOYSA-NCS-D0260AKOS025312626
Show more names
SB22690AS-39380DA-00756SY129279EN300-265437F468736F1903-0385
Database identifiers
- CAS
925903-31-7- PubChem CID
- 20437689
- EC Number
- 826-113-2
- Nikkaji
- J2.402.045B
Properties
Computed structural propertiesFilling in
- XLogP
- 0.1
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 61.5
Physicochemical properties
- Boiling point
- 200.4 · 200.4±23.0 °C(Predicted)
- Density
- 1.013 · 1.013±0.06 g/cm3(Predicted)
- storage temp.
- 0 · Store at 0-8 °C
- pka
- 15.02 · 15.02±0.10(Predicted)
- Symbol(GHS)
- 2 · GHS02
- Signal word
- Danger
- Hazard statements
- 225 · H225
- Precautionary statements
- 210 · P210-P233-P240-P241-P242-P243-P280-P303+P361+P353-P370+P378-P403+P235-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
Danger
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, 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 2 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%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS02
- Hazard statements
- H225
- Precautionary statements
- P210-P233-P240-P241-P242-P243-P280-P303+P361+P353-P370+P378-P403+P235-P501
Related reactions
2 records
Compound notes
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