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Home > Aldehydes > 164353-61-1
164353-61-1 | 1H-Indole-3-carboxaldehyde, 1,7-dimethyl-
CAS No: 164353-61-1 Catalog No: AG001UUG MDL No:MFCD11505321
Product Description
Catalog Number:
AG001UUG
Chemical Name:
1H-Indole-3-carboxaldehyde, 1,7-dimethyl-
CAS Number:
164353-61-1
Molecular Formula:
C11H11NO
Molecular Weight:
173.2111
MDL Number:
MFCD11505321
IUPAC Name:
1,7-dimethylindole-3-carbaldehyde
InChI:
InChI=1S/C11H11NO/c1-8-4-3-5-10-9(7-13)6-12(2)11(8)10/h3-7H,1-2H3
InChI Key:
FWIFXCARKJCTGL-UHFFFAOYSA-N
SMILES:
O=Cc1cn(c2c1cccc2C)C
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.084g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.215g/mol
Monoisotopic Mass:
173.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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