2-Phenyl-3-(pyrrolidin-1-yl)propan-1-ol

HCID 44890860
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Basic information

CAS
889942-49-8
Standard SMILES
OCC(CN1CCCC1)c1ccccc1
InChIKey
XDCCPZJVTGAGIX-UHFFFAOYSA-N
Molecular formula
C13H19NO
Average molar mass
205.3 g/mol
Monoisotopic mass
205.14666423

Names & identifiers

Preferred name
2-Phenyl-3-(pyrrolidin-1-yl)propan-1-ol
IUPAC
2-phenyl-3-pyrrolidin-1-ylpropan-1-ol
English name
2-Phenyl-3-pyrrolidin-1-yl-propan-1-ol
Molecular formula
C13H19NO
Molecular weight
205.3

Names & synonyms

889942-49-82-Phenyl-3-pyrrolidin-1-yl-propan-1-ol2-Phenyl-3-(pyrrolidin-1-yl)propan-1-olMFCD080612342-phenyl-3-pyrrolidin-1-ylpropan-1-olSCHEMBL3589625DTXSID30661365XDCCPZJVTGAGIX-UHFFFAOYSA-NAKOS016845823AB432642-phenyl-3-pyrrolidin-1-yl propan-1-olAS-38233
Show more names
1-Pyrrolidinepropanol, β-phenyl-1-Pyrrolidinepropanol, .beta.-phenyl-
DB-423626CS-0171279F040562

Database identifiers

CAS
889942-49-8
PubChem CID
44890860
DTXSID
DTXSID30661365

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
23.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
15

Physicochemical properties

Boiling point
331 · 331.0±30.0 °C(Predicted)
Density
1.064 · 1.064±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C
pka
14.65 · 14.65±0.10(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning

Safety & regulation

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Suppliers1 total

北京百灵威科技有限公司18210857532 18210857532 · [email protected]

Related reactions

4 records
New reaction record

Compound notes

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