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89130-75-6 | 1H-Pyrrolo[3,2-h]quinolinium, 2,9-dimethyl-, iodide
CAS No: 89130-75-6 Catalog No: AG003XSB MDL No:
Product Description
Catalog Number:
AG003XSB
Chemical Name:
1H-Pyrrolo[3,2-h]quinolinium, 2,9-dimethyl-, iodide
CAS Number:
89130-75-6
Molecular Formula:
C13H15IN2
Molecular Weight:
326.1761
IUPAC Name:
2,9-dimethyl-1,2-dihydropyrrolo[3,2-h]quinolin-1-ium;iodide
InChI:
InChI=1S/C13H14N2.HI/c1-9-8-11-6-5-10-4-3-7-15(2)13(10)12(11)14-9;/h3-9,14H,1-2H3;1H
InChI Key:
TYFCPMXLGNYMJF-UHFFFAOYSA-N
SMILES:
CC1[NH2+]c2c(=C1)ccc1c2n(C)ccc1.[I-]
Properties
Complexity:
461
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
326.028g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
326.181g/mol
Monoisotopic Mass:
326.028g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
19.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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