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Home > Indoles and Oxindole > 89969-98-2
89969-98-2 | 1H-Indole, 1,2-dimethyl-3-(1H-pyrrol-2-yl)-
CAS No: 89969-98-2 Catalog No: AG006N22 MDL No:
Product Description
Catalog Number:
AG006N22
Chemical Name:
1H-Indole, 1,2-dimethyl-3-(1H-pyrrol-2-yl)-
CAS Number:
89969-98-2
Molecular Formula:
C14H14N2
Molecular Weight:
210.2744
IUPAC Name:
1,2-dimethyl-3-(1H-pyrrol-2-yl)indole
InChI:
InChI=1S/C14H14N2/c1-10-14(12-7-5-9-15-12)11-6-3-4-8-13(11)16(10)2/h3-9,15H,1-2H3
InChI Key:
AQFRZYMGPHOTGA-UHFFFAOYSA-N
SMILES:
Cn1c(C)c(c2c1cccc2)c1ccc[nH]1
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.116g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
210.28g/mol
Monoisotopic Mass:
210.116g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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