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1-chloro-N,N-dimethylethenamine

HCID 19010376
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
C=C(Cl)N(C)C
InChIKey
BRLVAADCUUVYBX-UHFFFAOYSA-N
Molecular formula
C4H8ClN
Average molar mass
105.56 g/mol
Monoisotopic mass
105.034527

Names & identifiers

Preferred name
1-chloro-N,N-dimethylethenamine
IUPAC
1-chloro-N,N-dimethylethenamine

Names & synonyms

SCHEMBL24064001-chloro-N,N-dimethylethenamineBRLVAADCUUVYBX-UHFFFAOYSA-N

Database identifiers

PubChem CID
19010376

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
3.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
6
Formal charge
0
Complexity
58

Related reactions

8 records
New reaction record
HRID 872379 reaction equation
HRID 872379As reactantuspto-grants-2015_03
HRID 872380 reaction equation
HRID 872380As reactantuspto-grants-2015_03
HRID 934382 reaction equation
HRID 934382As reactantValidation data from https://doi.org/10.1039/C8SC04228D
HRID 1575567 reaction equation
HRID 1575567As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 1916779 reaction equation
HRID 1916779As reactantuspto-grants-2013_12
HRID 1916780 reaction equation
HRID 1916780As reactantuspto-grants-2013_12
HRID 2067041 reaction equation
HRID 2067041As reactantuspto-grants-2012_10
HRID 2067042 reaction equation
HRID 2067042As reactantuspto-grants-2012_10

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes