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1378875-98-9 | Quinoline, 5,6,7,8-tetrahydro-3-iodo-
CAS No: 1378875-98-9 Catalog No: AG00140R MDL No:
Product Description
Catalog Number:
AG00140R
Chemical Name:
Quinoline, 5,6,7,8-tetrahydro-3-iodo-
CAS Number:
1378875-98-9
Molecular Formula:
C9H10IN
Molecular Weight:
259.0869
IUPAC Name:
3-iodo-5,6,7,8-tetrahydroquinoline
InChI:
InChI=1S/C9H10IN/c10-8-5-7-3-1-2-4-9(7)11-6-8/h5-6H,1-4H2
InChI Key:
YYOQJNMKIAIOJB-UHFFFAOYSA-N
SMILES:
Ic1cnc2c(c1)CCCC2
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.986g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.09g/mol
Monoisotopic Mass:
258.986g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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