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680610-79-1

680610-79-1 | 1,3-Benzenediol, 4-(1-cyclohexyl-6-hydroxy-1H-indazol-3-yl)-

CAS No: 680610-79-1 Catalog No: AG006G91 MDL No:

Product Description

Catalog Number:
AG006G91
Chemical Name:
1,3-Benzenediol, 4-(1-cyclohexyl-6-hydroxy-1H-indazol-3-yl)-
CAS Number:
680610-79-1
Molecular Formula:
C19H20N2O3
Molecular Weight:
324.3737
IUPAC Name:
4-(1-cyclohexyl-6-hydroxyindazol-3-yl)benzene-1,3-diol
InChI:
InChI=1S/C19H20N2O3/c22-13-6-8-15-17(10-13)21(12-4-2-1-3-5-12)20-19(15)16-9-7-14(23)11-18(16)24/h6-12,22-24H,1-5H2
InChI Key:
QMJSDDUXUCNLMV-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)n(nc2c1ccc(cc1O)O)C1CCCCC1

Properties

Complexity:
429  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.147g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
324.38g/mol
Monoisotopic Mass:
324.147g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  

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