1-methyl-1H-pyrrole

ScientificNameLabel

1-methyl-1H-pyrrole
PHCD compound ID :	2106
Chemical Names :	1-methyl-1H-pyrrole
Molecular Formula :	C5H7N1
Molecular Weight :	81.057849

More Details :

Names & Synonyms:	1-methylpyrrole
Smiles:	Cn1cccc1
InChi :	InChI=1S/C5H7N/c1-6-4-2-3-5-6/h2-5H,1H3
InChi Key :	InChIKey=OXHNLMTVIGZXSG-UHFFFAOYSA-N
PubChem ID :	7304

Rotatable bond count :	0	Rule of five :	0
Hydrogen bond acceptor count :	1	Ionization potential :	8.838311
Hydrogen bond donor count :	0	Electric dipole moment :	3.071
XLogP :	1.123	VDW volume :	77.503766
Molecular weight :	81.057849	HOMO-LUMO gap :	10.009000

Herb list :

Tamarind, Indian date - Tamarindus indica - تمرهندی

Refrences & Litretures:


251. Journal:'Journal of Essential Oil Research' Year:'2004' Volume:'16' Page:'318' DOI:'10.1080/10412905.2004.9698731' Title:'Volatile Components of Tamarind (Tamarindus indica L.) Grown in Cuba'

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