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Home > Nitro Compounds > 125279-81-4
125279-81-4 | Oxirane, 2-[(4-nitrophenoxy)methyl]-, (2R)-
CAS No: 125279-81-4 Catalog No: AG000NFL MDL No:MFCD01709445
Product Description
Catalog Number:
AG000NFL
Chemical Name:
Oxirane, 2-[(4-nitrophenoxy)methyl]-, (2R)-
CAS Number:
125279-81-4
Molecular Formula:
C9H9NO4
Molecular Weight:
195.1721
MDL Number:
MFCD01709445
IUPAC Name:
(2R)-2-[(4-nitrophenoxy)methyl]oxirane
InChI:
InChI=1S/C9H9NO4/c11-10(12)7-1-3-8(4-2-7)13-5-9-6-14-9/h1-4,9H,5-6H2/t9-/m0/s1
InChI Key:
FPIGOBKNDYAZTP-VIFPVBQESA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)OC[C@@H]1OC1
UNII:
49IWT8U7IB
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
195.053g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.174g/mol
Monoisotopic Mass:
195.053g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
67.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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