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5-(Dimethylaminomethyl)-3-thiophenemethanol

HCID 12926499
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CN(C)Cc1cc(CO)cs1
InChIKey
MXRGSQKSECPROW-UHFFFAOYSA-N
Molecular formula
C8H13NOS
Average molar mass
171.26 g/mol

Names & identifiers

Preferred name
5-(Dimethylaminomethyl)-3-thiophenemethanol
IUPAC
[5-[(dimethylamino)methyl]thiophen-3-yl]methanol

Names & synonyms

78908-88-0SCHEMBL10674156MXRGSQKSECPROW-UHFFFAOYSA-N5-(Dimethylaminomethyl)-3-thiophenemethanolDB-1548805-[(Dimethylamino)methyl]-3-thiophenemethanol

Database identifiers

PubChem CID
12926499

Properties

Computed structural properties

XLogP
0.6
Topological polar surface area
51.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
11
Formal charge
0
Complexity
119

Related reactions

5 records
New reaction record
HRID 851101 reaction equation
HRID 851101As productuspto-grants-1983_05
HRID 851107 reaction equation
HRID 851107As productuspto-grants-1983_05
HRID 867917 reaction equation
HRID 867917As productuspto-grants-1988_10
HRID 867923 reaction equation
HRID 867923As productuspto-grants-1988_10
HRID 2159431 reaction equation
HRID 2159431As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes