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2-Chloro-1-pyrroline (HCID 13520141)|Huagongshe
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Compound
2-Chloro-1-pyrroline
HCID
13520141
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Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
ClC1=NCCC1
InChIKey
SHGWHWLYMGIVPN-UHFFFAOYSA-N
Molecular formula
C4H6ClN
Average molar mass
103.55 g/mol
Names & identifiers
Preferred name
2-Chloro-1-pyrroline
IUPAC
5-chloro-3,4-dihydro-2H-pyrrole
Names & synonyms
2-chloro-1-pyrroline
SCHEMBL7456841
SHGWHWLYMGIVPN-UHFFFAOYSA-N
Database identifiers
PubChem CID
13520141
Properties
Computed structural properties
XLogP
0.7
Topological polar surface area
12.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
6
Formal charge
0
Complexity
77.6
Show all 8
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Related reactions
7 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
102895
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID
134983
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID
484785
As reactant
uspto-grants-1985_08
HRID
484787
As reactant
uspto-grants-1985_08
HRID
484803
As reactant
uspto-grants-1985_08
HRID
484806
As reactant
uspto-grants-1985_08
HRID
484807
As reactant
uspto-grants-1985_08
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Compound notes
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