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Home > Aldehydes > 126309-77-1
126309-77-1 | 1H-Indole-2-carboxaldehyde, 3-chloro-1-methyl-
CAS No: 126309-77-1 Catalog No: AG000SJY MDL No:
Product Description
Catalog Number:
AG000SJY
Chemical Name:
1H-Indole-2-carboxaldehyde, 3-chloro-1-methyl-
CAS Number:
126309-77-1
Molecular Formula:
C10H8ClNO
Molecular Weight:
193.6296
IUPAC Name:
3-chloro-1-methylindole-2-carbaldehyde
InChI:
InChI=1S/C10H8ClNO/c1-12-8-5-3-2-4-7(8)10(11)9(12)6-13/h2-6H,1H3
InChI Key:
WGXUSIVWAUMPNX-UHFFFAOYSA-N
SMILES:
O=Cc1c(Cl)c2c(n1C)cccc2
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.029g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.63g/mol
Monoisotopic Mass:
193.029g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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