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Home > Nitro Compounds > 1803604-61-6
1803604-61-6 | 6-(3-methyloxetan-3-yl)-5-nitropiperidin-2-one
CAS No: 1803604-61-6 Catalog No: AG01BAD4 MDL No:MFCD28397602
Product Description
Catalog Number:
AG01BAD4
Chemical Name:
6-(3-methyloxetan-3-yl)-5-nitropiperidin-2-one
CAS Number:
1803604-61-6
Molecular Formula:
C9H14N2O4
Molecular Weight:
214.2185
MDL Number:
MFCD28397602
IUPAC Name:
6-(3-methyloxetan-3-yl)-5-nitropiperidin-2-one
InChI:
InChI=1S/C9H14N2O4/c1-9(4-15-5-9)8-6(11(13)14)2-3-7(12)10-8/h6,8H,2-5H2,1H3,(H,10,12)
InChI Key:
ZCPJCXNOXJCMGD-UHFFFAOYSA-N
SMILES:
O=C1CCC(C(N1)C1(C)COC1)[N+](=O)[O-]
Properties
Complexity:
295
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.095g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
214.221g/mol
Monoisotopic Mass:
214.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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