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Home > Indoles and Oxindole > 99275-49-7
99275-49-7 | 1H-Indole, 2-iodo-5-methoxy-
CAS No: 99275-49-7 Catalog No: AG00665N MDL No:MFCD13177451
Product Description
Catalog Number:
AG00665N
Chemical Name:
1H-Indole, 2-iodo-5-methoxy-
CAS Number:
99275-49-7
Molecular Formula:
C9H8INO
Molecular Weight:
273.0704
MDL Number:
MFCD13177451
IUPAC Name:
2-iodo-5-methoxy-1H-indole
InChI:
InChI=1S/C9H8INO/c1-12-7-2-3-8-6(4-7)5-9(10)11-8/h2-5,11H,1H3
InChI Key:
ZAJMEADSVWEEQK-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)cc([nH]2)I
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.965g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
273.073g/mol
Monoisotopic Mass:
272.965g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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