C1=CNC=C1
CAS: 109-97-7
Name: 1H-pyrrole
SMILES: C1=CNC=C1

Molecular Processing

Molecular formula
C4H5N
Molecular weight
67.09
Exact mass
67.0422
XLogP
1.01
TPSA
15.79
H-bond donors
1
H-bond acceptors
0
Rotatable bonds
0
Heavy atoms
5
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0
Molar refractivity
20.79

Supplementary Information

InChIKey: KAESVJOAVNADME-UHFFFAOYSA-N
Synonyme
PYRROLE1H-Pyrrole109-97-7AzoleDivinylenimineImidolePyrrolMonopyrroleDivinyleneimine1-Aza-2,4-cyclopentadieneFEMA No. 3386PyrrolesDTXSID5021910NSC-6277786S1ZD6L2CCHEBI:19203DTXCID201910Pyrrole 1539RefChem:6188CHEBI:26455CHEBI:35556203-724-7Pyrrole-15NC4H5NNSC 62777(1H-Pyrrole)xPYROLLEMFCD0000521626120-22-9Polypyrrole (undoped, extent of labeling: ~20 wt. % loading, composite with carbon black)
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