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126590-88-3

126590-88-3 | 1H-Indole, 4-chloro-1-nitroso-

CAS No: 126590-88-3 Catalog No: AG000SZR MDL No:MFCD01718957

Product Description

Catalog Number:
AG000SZR
Chemical Name:
1H-Indole, 4-chloro-1-nitroso-
CAS Number:
126590-88-3
Molecular Formula:
C8H5ClN2O
Molecular Weight:
180.5911
MDL Number:
MFCD01718957
IUPAC Name:
4-chloro-1-nitrosoindole
InChI:
InChI=1S/C8H5ClN2O/c9-7-2-1-3-8-6(7)4-5-11(8)10-12/h1-5H
InChI Key:
HIJZOLDFHYLQHH-UHFFFAOYSA-N
SMILES:
O=Nn1ccc2c1cccc2Cl

Properties

Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.009g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.591g/mol
Monoisotopic Mass:
180.009g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

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