C1=CNC(=C1)C(=O)C(Cl)(Cl)Cl
CAS: 35302-72-8
Name: 2,2,2-trichloro-1-(1H-pyrrol-2-yl)ethanone
SMILES: C1=CNC(=C1)C(=O)C(Cl)(Cl)Cl

Molecular Processing

Molecular formula
C6H4Cl3NO
Molecular weight
212.46
Exact mass
210.9358
XLogP
2.57
TPSA
32.86
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
45.41

Supplementary Information

InChIKey: BBFDGMDENAEMKF-UHFFFAOYSA-N
Synonyme
2-(Trichloroacetyl)pyrroleDTXSID70313578RefChem:462443DTXCID60264702671-031-035302-72-82,2,2-Trichloro-1-(1H-pyrrol-2-yl)ethanone2,2,2-Trichloro-1-(1H-pyrrol-2-yl)ethan-1-oneMFCD00128757Ethanone, 2,2,2-trichloro-1-(1H-pyrrol-2-yl)-2-(trichloroacetyl)-1h-pyrrole2-trichloroacetyl-1H-pyrrole2,2,2-trichloro-1-(1h-pyrrol-2-yl)-ethanone2,2,2-trichloro-1-pyrrol-2-ylethan-1-one2-Pyrrolyl trichloromethyl ketone2,2,2-Trichloro-1-(1H-pyrrol-2-yl)ethanone; 2,2,2-Trichloro-1-(1H-pyrrol-2-yl)ethanone; 2-(Trichloroacetyl)-1H-pyrrole; NSC 272669; Pyrrol-2-yl Trichloromethyl Ketone;NSC272669trichloroacetyl pyrrole2-trichloracetyl pyrrole2-trichloroacetyl pyrrole2-Trichloroacetylpyrrolidine2-(trichloroacetyl) pyrrole2-(trichloroacetyl)-pyrroleSCHEMBL260683SCHEMBL498350CHEMBL49948762-(Trichloroacetyl)pyrrole, 99%pyrrol-2-yl trichloromethyl ketoneSBB055785AKOS001127825
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