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65513-22-6

65513-22-6 | 4-methyl-2-(4-nitrophenyl)-1,3-dioxolane

CAS No: 65513-22-6 Catalog No: AG00ITP7 MDL No:

Product Description

Catalog Number:
AG00ITP7
Chemical Name:
4-methyl-2-(4-nitrophenyl)-1,3-dioxolane
CAS Number:
65513-22-6
Molecular Formula:
C10H11NO4
Molecular Weight:
209.1986
IUPAC Name:
4-methyl-2-(4-nitrophenyl)-1,3-dioxolane
InChI:
InChI=1S/C10H11NO4/c1-7-6-14-10(15-7)8-2-4-9(5-3-8)11(12)13/h2-5,7,10H,6H2,1H3
InChI Key:
XDNXNKYDMUJERW-UHFFFAOYSA-N
SMILES:
CC1COC(O1)c1ccc(cc1)[N+](=O)[O-]

Properties

Complexity:
232  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.069g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.201g/mol
Monoisotopic Mass:
209.069g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

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