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Home > Nitro Compounds > 21837-34-3
21837-34-3 | 5-nitro-2-(prop-2-en-1-yloxy)phenol
CAS No: 21837-34-3 Catalog No: AG01C3ZS MDL No:MFCD25961094
Product Description
Catalog Number:
AG01C3ZS
Chemical Name:
5-nitro-2-(prop-2-en-1-yloxy)phenol
CAS Number:
21837-34-3
Molecular Formula:
C9H9NO4
Molecular Weight:
195.1721
MDL Number:
MFCD25961094
IUPAC Name:
5-nitro-2-prop-2-enoxyphenol
InChI:
InChI=1S/C9H9NO4/c1-2-5-14-9-4-3-7(10(12)13)6-8(9)11/h2-4,6,11H,1,5H2
InChI Key:
JAPVPRIFBMBJAR-UHFFFAOYSA-N
SMILES:
C=CCOc1ccc(cc1O)[N+](=O)[O-]
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
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:
1
Isotope Atom Count:
0
Molecular Weight:
195.174g/mol
Monoisotopic Mass:
195.053g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
75.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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