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6086-33-5 | 4-azido-3-nitrophenol
CAS No: 6086-33-5 Catalog No: AG01C317 MDL No:MFCD29055190
Product Description
Catalog Number:
AG01C317
Chemical Name:
4-azido-3-nitrophenol
CAS Number:
6086-33-5
Molecular Formula:
C6H4N4O3
Molecular Weight:
180.1210
MDL Number:
MFCD29055190
IUPAC Name:
4-azido-3-nitrophenol
InChI:
InChI=1S/C6H4N4O3/c7-9-8-5-2-1-4(11)3-6(5)10(12)13/h1-3,11H
InChI Key:
QZSRALKCZPBKBB-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=Nc1ccc(cc1[N+](=O)[O-])O
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.028g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
180.123g/mol
Monoisotopic Mass:
180.028g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
80.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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