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24031-70-7

24031-70-7 | 3-(2-METHOXYPHENYL)-5(4H)-ISOXAZOLONE

CAS No: 24031-70-7 Catalog No: AG00CCID MDL No:MFCD21334965

Product Description

Catalog Number:
AG00CCID
Chemical Name:
3-(2-METHOXYPHENYL)-5(4H)-ISOXAZOLONE
CAS Number:
24031-70-7
Molecular Formula:
C10H9NO3
Molecular Weight:
191.1834
MDL Number:
MFCD21334965
IUPAC Name:
3-(2-methoxyphenyl)-4H-1,2-oxazol-5-one
InChI:
InChI=1S/C10H9NO3/c1-13-9-5-3-2-4-7(9)8-6-10(12)14-11-8/h2-5H,6H2,1H3
InChI Key:
VUWSKOMGIBDYIT-UHFFFAOYSA-N
SMILES:
COc1ccccc1C1=NOC(=O)C1

Properties

Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.058g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.186g/mol
Monoisotopic Mass:
191.058g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
47.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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