Home Nitros 2-[3-methyl-2-(nitromethyl)-5-oxocyclopentyl]acetic acid

2-[3-methyl-2-(nitromethyl)-5-oxocyclopentyl]acetic acid

CAS No.:
345637-74-3
Catalog Number:
AG019P7D
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG019P7D
Chemical Name:
2-[3-methyl-2-(nitromethyl)-5-oxocyclopentyl]acetic acid
CAS Number:
345637-74-3
MDL Number:
MFCD01002103
IUPAC Name:
2-[3-methyl-2-(nitromethyl)-5-oxocyclopentyl]acetic acid
InChI:
InChI=1S/C9H13NO5/c1-5-2-8(11)6(3-9(12)13)7(5)4-10(14)15/h5-7H,2-4H2,1H3,(H,12,13)
InChI Key:
YPCIKCQPODDZAT-UHFFFAOYSA-N
Properties
Complexity:
295  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.079g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
215.205g/mol
Monoisotopic Mass:
215.079g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties