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1266386-30-4

1266386-30-4 | 1H-Indazole, 6-iodo-1-(tetrahydro-2H-pyran-2-yl)-

CAS No: 1266386-30-4 Catalog No: AG000T1Z MDL No:MFCD22380254

Product Description

Catalog Number:
AG000T1Z
Chemical Name:
1H-Indazole, 6-iodo-1-(tetrahydro-2H-pyran-2-yl)-
CAS Number:
1266386-30-4
Molecular Formula:
C12H13IN2O
Molecular Weight:
328.1489
MDL Number:
MFCD22380254
IUPAC Name:
6-iodo-1-(oxan-2-yl)indazole
InChI:
InChI=1S/C12H13IN2O/c13-10-5-4-9-8-14-15(11(9)7-10)12-3-1-2-6-16-12/h4-5,7-8,12H,1-3,6H2
InChI Key:
BANHPSSSKHRVFC-UHFFFAOYSA-N
SMILES:
Ic1ccc2c(c1)n(nc2)C1CCCCO1

Properties

Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.007g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
328.153g/mol
Monoisotopic Mass:
328.007g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

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