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82194-12-5 | 2H-Pyrrole, 5-ethyl-3,4-dihydro-4-(1-methylethylidene)-
CAS No: 82194-12-5 Catalog No: AG0056N0 MDL No:
Product Description
Catalog Number:
AG0056N0
Chemical Name:
2H-Pyrrole, 5-ethyl-3,4-dihydro-4-(1-methylethylidene)-
CAS Number:
82194-12-5
Molecular Formula:
C9H15N
Molecular Weight:
137.2221
IUPAC Name:
5-ethyl-4-propan-2-ylidene-2,3-dihydropyrrole
InChI:
InChI=1S/C9H15N/c1-4-9-8(7(2)3)5-6-10-9/h4-6H2,1-3H3
InChI Key:
JPTDZSFKKJBEPL-UHFFFAOYSA-N
SMILES:
CCC1=NCCC1=C(C)C
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.12g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
137.226g/mol
Monoisotopic Mass:
137.12g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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