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Home Other Building Blocks 5-(But-1-yn-1-yl)-1-(tetrahydro-2H-pyran-2-yl)-1H-indazole

5-(But-1-yn-1-yl)-1-(tetrahydro-2H-pyran-2-yl)-1H-indazole

CAS No.:
1365889-00-4
Catalog Number:
AG01DTOD
Molecular Formula:
C16H18N2O
Molecular Weight:
254.3269
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$104
- +
250mg
95%
In Stock USA
United States
$189
- +
1g
95%
In Stock USA
United States
$378
- +
Product Description
Catalog Number:
AG01DTOD
Chemical Name:
5-(But-1-yn-1-yl)-1-(tetrahydro-2H-pyran-2-yl)-1H-indazole
CAS Number:
1365889-00-4
Molecular Formula:
C16H18N2O
Molecular Weight:
254.3269
MDL Number:
MFCD28142748
IUPAC Name:
5-but-1-ynyl-1-(oxan-2-yl)indazole
InChI:
InChI=1S/C16H18N2O/c1-2-3-6-13-8-9-15-14(11-13)12-17-18(15)16-7-4-5-10-19-16/h8-9,11-12,16H,2,4-5,7,10H2,1H3
InChI Key:
FAYLJVQBPJVUKH-UHFFFAOYSA-N
SMILES:
CCC#Cc1ccc2c(c1)cnn2C1CCCCO1
Properties
Complexity:
369  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.142g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.333g/mol
Monoisotopic Mass:
254.142g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties