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1137278-45-5

1137278-45-5 | 1H-Indazole, 4-chloro-1-(tetrahydro-2H-pyran-2-yl)-

CAS No: 1137278-45-5 Catalog No: AG0009GS MDL No:MFCD20482716

Product Description

Catalog Number:
AG0009GS
Chemical Name:
1H-Indazole, 4-chloro-1-(tetrahydro-2H-pyran-2-yl)-
CAS Number:
1137278-45-5
Molecular Formula:
C12H13ClN2O
Molecular Weight:
236.6974
MDL Number:
MFCD20482716
IUPAC Name:
4-chloro-1-(oxan-2-yl)indazole
InChI:
InChI=1S/C12H13ClN2O/c13-10-4-3-5-11-9(10)8-14-15(11)12-6-1-2-7-16-12/h3-5,8,12H,1-2,6-7H2
InChI Key:
MFGIVPTZAMUOSU-UHFFFAOYSA-N
SMILES:
Clc1cccc2c1cnn2C1CCCCO1

Properties

Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.072g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.699g/mol
Monoisotopic Mass:
236.072g/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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