AG00ECQA

59646-16-1 | 6,7-Dihydro-5H-pyrrolo[1,2-a]imidazole

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CAS Number	59646-16-1
Catalog Number	AG00ECQA(AGN-PC-0N4IGF)
Chemical Name	6,7-Dihydro-5H-pyrrolo[1,2-a]imidazole
IUPAC Name	6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
InChI	InChI=1S/C6H8N2/c1-2-6-7-3-5-8(6)4-1/h3,5H,1-2,4H2
InChI Key	ZWETXQBHVRWLPW-UHFFFAOYSA-N
MDL Number	MFCD11870771
Molecular Formula	C6H8N2
Molecular Weight	108.1411
SMILES	c12n(ccn2)CCC1
Synonyms	6,7-dihydro-5H-pyrrolo(1,2-a)imidazole, DPI compound, 6,7-dihydro-5H-pyrrolo[1,2-a]imidazole, 59646-16-1, 5H,6H,7H-pyrrolo[1,2-a]imidazole, 6,7-dihydro-[5H]pyrrolo[1,2-a]imidazole, pyrrolidino[1,2-a]imidazole, SCHEMBL712267, CHEMBL3304093, CTK5B0235, DTXSID30439869, 8877AB, ANW-66658, BBL103572, MFCD11870771, SBB056323, STL557382, ZINC38864208, AKOS015905422, MCULE-3501869016, NE49714, SC-83537, 5H-Pyrrolo[1,2-a]imidazole,6,7-dihydro-, DB-072668, TC-070450, 4CH-004366, FT-0083596, FT-0646368, ST24044989, 4,5,6,7-tetrahydro-pyrrolo[1,2-a]imidazole, I14-2912, I14-22701, Z1737940689, C6H8N2, CID10441661, 1,4-diazabicyclo[3.3.0]octa-2,4-diene, A8374,

Complexity	92.5
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	108.069g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	108.144g/mol
Monoisotopic Mass	108.069g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	17.8A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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