Home Other Building Blocks 1-(propan-2-yl)-2,5-dihydro-1H-pyrrole

1-(propan-2-yl)-2,5-dihydro-1H-pyrrole

CAS No.:
142651-63-6
Catalog Number:
AG01ELWL
Molecular Formula:
C7H13N
Molecular Weight:
111.1848
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Product Description
Catalog Number:
AG01ELWL
Chemical Name:
1-(propan-2-yl)-2,5-dihydro-1H-pyrrole
CAS Number:
142651-63-6
Molecular Formula:
C7H13N
Molecular Weight:
111.1848
MDL Number:
MFCD31665745
IUPAC Name:
1-propan-2-yl-2,5-dihydropyrrole
InChI:
InChI=1S/C7H13N/c1-7(2)8-5-3-4-6-8/h3-4,7H,5-6H2,1-2H3
InChI Key:
MXJXGVAHWNWPHD-UHFFFAOYSA-N
SMILES:
CC(N1CC=CC1)C
Properties
Complexity:
86.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
111.105g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
111.188g/mol
Monoisotopic Mass:
111.105g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties