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81778-66-7

81778-66-7 | 3-Isoxazolidinone, 2-[(2,5-dichlorophenyl)methyl]-4,4-dimethyl-

CAS No: 81778-66-7 Catalog No: AG0050MS MDL No:

Product Description

Catalog Number:
AG0050MS
Chemical Name:
3-Isoxazolidinone, 2-[(2,5-dichlorophenyl)methyl]-4,4-dimethyl-
CAS Number:
81778-66-7
Molecular Formula:
C12H13Cl2NO2
Molecular Weight:
274.1431
IUPAC Name:
2-[(2,5-dichlorophenyl)methyl]-4,4-dimethyl-1,2-oxazolidin-3-one
InChI:
InChI=1S/C12H13Cl2NO2/c1-12(2)7-17-15(11(12)16)6-8-5-9(13)3-4-10(8)14/h3-5H,6-7H2,1-2H3
InChI Key:
ZTMOLOVAQWCURR-UHFFFAOYSA-N
SMILES:
O=C1N(OCC1(C)C)Cc1cc(Cl)ccc1Cl

Properties

Complexity:
309  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.032g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.141g/mol
Monoisotopic Mass:
273.032g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  

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