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Home Nitros N-(3-Hydroxypropyl) 4-hydroxy-2-nitroaniline

N-(3-Hydroxypropyl) 4-hydroxy-2-nitroaniline

CAS No.:
92952-81-3
Catalog Number:
AG003JTG
Molecular Formula:
C9H12N2O4
Molecular Weight:
212.2026
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$19
- +
25g
98%
In Stock USA
United States
$62
- +
100g
98%
In Stock USA
United States
$150
- +
500g
98%
In Stock USA
United States
$525
- +
Product Description
Catalog Number:
AG003JTG
Chemical Name:
N-(3-Hydroxypropyl) 4-hydroxy-2-nitroaniline
CAS Number:
92952-81-3
Molecular Formula:
C9H12N2O4
Molecular Weight:
212.2026
MDL Number:
MFCD07368637
IUPAC Name:
4-(3-hydroxypropylamino)-3-nitrophenol
InChI:
InChI=1S/C9H12N2O4/c12-5-1-4-10-8-3-2-7(13)6-9(8)11(14)15/h2-3,6,10,12-13H,1,4-5H2
InChI Key:
VTXBLQLZQLHDIL-UHFFFAOYSA-N
SMILES:
OCCCNc1ccc(cc1[N+](=O)[O-])O
UNII:
X89W3M6X79
Properties
Complexity:
207  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.08g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
212.205g/mol
Monoisotopic Mass:
212.08g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
98.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Literature
Title Journal
Final report on the safety assessment of amino nitrophenols as used in hair dyes. International journal of toxicology 20090101
Properties