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Home > Aldehydes > 1227575-94-1
1227575-94-1 | 7-CHLORO-6-HYDROXY-1H-INDOLE-3-CARBALDEHYDE
CAS No: 1227575-94-1 Catalog No: AG01DDXW MDL No:
Product Description
Catalog Number:
AG01DDXW
Chemical Name:
7-CHLORO-6-HYDROXY-1H-INDOLE-3-CARBALDEHYDE
CAS Number:
1227575-94-1
Molecular Formula:
C9H6ClNO2
Molecular Weight:
195.6024
IUPAC Name:
7-chloro-6-hydroxy-1H-indole-3-carbaldehyde
InChI:
InChI=1S/C9H6ClNO2/c10-8-7(13)2-1-6-5(4-12)3-11-9(6)8/h1-4,11,13H
InChI Key:
HDWZZORVUSVMJI-UHFFFAOYSA-N
SMILES:
O=Cc1c[nH]c2c1ccc(c2Cl)O
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.009g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
195.602g/mol
Monoisotopic Mass:
195.009g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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