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Home > Nitro Compounds > 832102-13-3
832102-13-3 | Oxirane, [[2-(methoxymethoxy)-5-nitrophenoxy]methyl]-, (2R)-
CAS No: 832102-13-3 Catalog No: AG004UZN MDL No:
Product Description
Catalog Number:
AG004UZN
Chemical Name:
Oxirane, [[2-(methoxymethoxy)-5-nitrophenoxy]methyl]-, (2R)-
CAS Number:
832102-13-3
Molecular Formula:
C11H13NO6
Molecular Weight:
255.2240
IUPAC Name:
(2R)-2-[[2-(methoxymethoxy)-5-nitrophenoxy]methyl]oxirane
InChI:
InChI=1S/C11H13NO6/c1-15-7-18-10-3-2-8(12(13)14)4-11(10)17-6-9-5-16-9/h2-4,9H,5-7H2,1H3/t9-/m1/s1
InChI Key:
XCKDLEDCGWEDOQ-SECBINFHSA-N
SMILES:
COCOc1ccc(cc1OC[C@@H]1OC1)[N+](=O)[O-]
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
255.074g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.226g/mol
Monoisotopic Mass:
255.074g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
86A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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