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1-Methoxypiperidin-4-ol

HCID 3022606
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
93841-20-4
Standard SMILES
CON1CCC(O)CC1
InChIKey
SMXILXHGRZEYOP-UHFFFAOYSA-N
Molecular formula
C6H13NO2
Average molar mass
131.17 g/mol
Monoisotopic mass
131.09462866

Names & identifiers

Preferred name
1-Methoxypiperidin-4-ol
IUPAC
1-methoxypiperidin-4-ol
English name
1-methoxypiperidin-4-ol
Molecular formula
C6H13NO2
Molecular weight
131.17

Names & synonyms

1-Methoxypiperidin-4-ol93841-20-4EINECS 298-990-41-methoxy-piperidin-4-olSCHEMBL37176DTXSID40917562MFCD26695581SY352671NS000647731-Methoxy-4-piperidinol4-Piperidinol, 1-methoxy-

Database identifiers

CAS
93841-20-4
PubChem CID
3022606
DTXSID
DTXSID40917562
EC Number
298-990-4
Nikkaji
J320.529K

Properties

Computed structural properties

XLogP
0.2
Topological polar surface area
32.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
9
Formal charge
0
Complexity
79.1

Physicochemical properties

Boiling point
194.9 · 194.9±50.0 °C(Predicted)
Density
1.09 · 1.09±0.1 g/cm3(Predicted)
pka
14.95 · 14.95±0.20(Predicted)

Chemistry & industry

Suppliers3 total

韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
北京珐默兹医药科技有限公司15811073878 · [email protected]
杭州陶瑞生物科技有限公司QQ1259737804 15268198094 · [email protected]

Related reactions

6 records
New reaction record
HRID 1229341 reaction equation
HRID 1229341As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1473783 reaction equation
HRID 1473783As productuspto-grants-2015_04
HRID 1473784 reaction equation
HRID 1473784As reactantuspto-grants-2015_04
HRID 2035305 reaction equation
HRID 2035305As productuspto-grants-2013_11
HRID 2035306 reaction equation
HRID 2035306As reactantuspto-grants-2013_11
HRID 2129844 reaction equation
HRID 2129844As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes