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10080-44-1

10080-44-1 | 1-Propanone, 1-(2-hydroxy-5-methylphenyl)-, oxime

CAS No: 10080-44-1 Catalog No: AG0002X1 MDL No:

Product Description

Catalog Number:
AG0002X1
Chemical Name:
1-Propanone, 1-(2-hydroxy-5-methylphenyl)-, oxime
CAS Number:
10080-44-1
Molecular Formula:
C10H13NO2
Molecular Weight:
179.2157
IUPAC Name:
2-(C-ethyl-N-hydroxycarbonimidoyl)-4-methylphenol
InChI:
InChI=1S/C10H13NO2/c1-3-9(11-13)8-6-7(2)4-5-10(8)12/h4-6,12-13H,3H2,1-2H3
InChI Key:
ORIIBRPXSQXWGI-UHFFFAOYSA-N
SMILES:
CCC(=NO)c1cc(C)ccc1O

Properties

Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.095g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
179.219g/mol
Monoisotopic Mass:
179.095g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.3  

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