Home Nitro Compounds 10572-16-4
10572-16-4,MFCD00043748
Catalog No.:AA003I2H
10572-16-4 | 3-(4-Nitrophenoxy)propionic acid
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1g
98%(HPLC)
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$163.00   $114.00
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5g
98%(HPLC)
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Technical Information
Catalog Number:
AA003I2H
Chemical Name:
3-(4-Nitrophenoxy)propionic acid
CAS Number:
10572-16-4
Molecular Formula:
C9H9NO5
Molecular Weight:
211.1715
MDL Number:
MFCD00043748
IUPAC Name:
3-(4-nitrophenoxy)propanoic acid
InChI:
InChI=1S/C9H9NO5/c11-9(12)5-6-15-8-3-1-7(2-4-8)10(13)14/h1-4H,5-6H2,(H,11,12)
InChI Key:
RRQDYEMTBDVXQY-UHFFFAOYSA-N
SMILES:
OC(=O)CCOc1ccc(cc1)[N+](=O)[O-]
NSC Number:
522110
Properties
Computed Properties
 
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.048g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
211.173g/mol
Monoisotopic Mass:
211.048g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

Synonyms
 
3-(4-Nitrophenoxy)propionic acid 
10572-16-4 
3-(4-Nitrophenoxy)propionicAcid 
CTK7J4481 
3-(p-nitrophenoxy)Propanoic acid 
3-[p-nitrophenoxy] propionic acid 
KS-00000CL4 
ZINC1605127 
3-(4-nitro-phenoxy)-propionic acid 
3-(4-Nitrophenoxy)propanoic acid # 
5664AJ 
MFCD00043748 
3-(4-Nitrophenoxy)propanoic acid 
NSC522110 
SBB007969 
AKOS000137578 
FR-0678 
MCULE-6207171899 
NSC-522110 
TRA0061862 
AK187215 
AS-31099 
SY008326 
RRQDYEMTBDVXQY-UHFFFAOYSA-N 
AB0065940 
DB-059386 
TR-001181 
FT-0613695 
ST50828080 
EN300-36067 
Z-4049 
MFCD00043748 (97+%) 
I01-7884 
Z367678492 
3-[p-Nitrophenoxy]propionic acid 
C9H9NO5 
3-(4-nitrophenyl)propionic acid 
CID351535 
1086138-36-4 
PubChem19206 
AC1L6YJ3 
AC1Q75PP 
SCHEMBL3032142 
Jsp000534 
Literature
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