(4-Phenylpyrrolidin-3-yl)methanol

HCID 13316928CAS 848307-24-4
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Basic information

Standard SMILES
OCC1CNCC1c1ccccc1
InChIKey
MMDOXIYRYUVGPQ-UHFFFAOYSA-N
Molecular formula
C11H15NO
Average molar mass
177.24 g/mol
Monoisotopic mass
177.1153641

Names & identifiers

Preferred name
(4-Phenylpyrrolidin-3-yl)methanol
IUPAC
(4-phenylpyrrolidin-3-yl)methanol
English name
((3R,4S)-4-Phenylpyrrolidin-3-yl)methanol
Molecular formula
C11H15NO
Molecular weight
177.24

Names & synonyms

(4-phenylpyrrolidin-3-yl)methanol55438-50-13-(SR)-hydroxymethyl-4-(SR)-phenylpyrrolidineSCHEMBL1239831DTXSID40536595MMDOXIYRYUVGPQ-UHFFFAOYSA-NAKOS004119320DA-04919F1908-1449((3R,4S)-4-Phenylpyrrolidin-3-yl)methanol3-Pyrrolidinemethanol, 4-phenyl-, (3R,4S)-(3R,4S)-3-hydroxymethyl-4-phenylpyrrolidine
Show more names
(3R,4S)-3-hydroxymethyl-4-phenylpyrrolidine hydrochloride

Database identifiers

CAS
848307-24-4
PubChem CID
13316928
DTXSID
DTXSID40536595

Properties

Computed structural properties

XLogP
0.9
Topological polar surface area
32.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
13

Physicochemical properties

Boiling point
316.1 · 316.1±25.0 °C(Predicted)
Density
1.058 · 1.058±0.06 g/cm3(Predicted)
pka
14.93 · 14.93±0.10(Predicted)
CAS DataBase Reference
848307 · 848307-24-4(CAS DataBase Reference)

Chemistry & industry

Suppliers6 total

成都福尔斯特医药技术有限公司028-87078428 028-87074958 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
上海书亚医药科技有限公司400-685-9117 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
重庆卡兰医药有限公司[email protected]

Related reactions

9 records
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Linked notes

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