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Home > Aldehydes > 176327-44-9
176327-44-9 | 1H-Indole-2-carboxaldehyde, 3-iodo-
CAS No: 176327-44-9 Catalog No: AG0024LC MDL No:MFCD18450092
Product Description
Catalog Number:
AG0024LC
Chemical Name:
1H-Indole-2-carboxaldehyde, 3-iodo-
CAS Number:
176327-44-9
Molecular Formula:
C9H6INO
Molecular Weight:
271.0545
MDL Number:
MFCD18450092
IUPAC Name:
3-iodo-1H-indole-2-carbaldehyde
InChI:
InChI=1S/C9H6INO/c10-9-6-3-1-2-4-7(6)11-8(9)5-12/h1-5,11H
InChI Key:
ZYZVPGMSKQLUMR-UHFFFAOYSA-N
SMILES:
O=Cc1[nH]c2c(c1I)cccc2
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.949g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
271.057g/mol
Monoisotopic Mass:
270.949g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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