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Home Nitro Compounds 100-13-0
100-13-0,MFCD00041254
Catalog No.:AA000033
100-13-0 | 4-Nitrostyrene
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1g
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5g
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10g
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Technical Information
Catalog Number:
AA000033
Chemical Name:
4-Nitrostyrene
CAS Number:
100-13-0
Molecular Formula:
C8H7NO2
Molecular Weight:
149.1467
MDL Number:
MFCD00041254
IUPAC Name:
1-ethenyl-4-nitrobenzene
InChI:
InChI=1S/C8H7NO2/c1-2-7-3-5-8(6-4-7)9(10)11/h2-6H,1H2
InChI Key:
YFZHODLXYNDBSM-UHFFFAOYSA-N
SMILES:
C=Cc1ccc(cc1)[N+](=O)[O-]
Properties
Computed Properties
 
Complexity:
154  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.048g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
149.149g/mol
Monoisotopic Mass:
149.048g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

Synonyms
 
4-Nitrostyrene 
1-Nitro-4-vinylbenzene 
MFCD00041254 
nitrovinylbenzene 
4-nitro-styrene 
p-nitrophenylethylene 
ACMC-20amc0 
AC1L1OUY 
AC1Q5AQG 
1-Nitro-4-vinyl-benzene 
SCHEMBL125083 
CHEMBL164351 
100-13-0 
Jsp000061 
CTK5J3525 
DTXSID70142845 
ZINC153489 
KS-00000O7W 
4-Nitrostyrene(Stabilized With Tbc) 
SBB086621 
AKOS004906720 
AKOS015967330 
CS-W004451 
p-Nitrostyrene 
MCULE-5796730918 
RP09973 
RTR-000043 
AJ-13005 
AK135882 
LS-147228 
ST2403487 
TR-000043 
4CH-018726 
FT-0619301 
1-Ethenyl-4-nitrobenzene 
N0503 
Z2333 
9T-0616 
J-505029 
J-640226 
J-800227 
I01-12543 
InChI=1/C8H7NO2/c1-2-7-3-5-8(6-4-7)9(10)11/h2-6H,1H 
Ethyl 3-benzoylacrylate 
Benzene,1-ethenyl-4-nitro- 
Benzene, 1-ethenyl-4-nitro- 
C8H7NO2 
CID7481 
C8-H7-N-O2 
4-Nitrostyrene, 95% - 1G 1g 
AR-1C4882 
100504-83-4 
CCRIS 1674 
STYRENE, p-NITRO- 
Benzene, 1-ethenyl-4-nitro- (9CI) 
YFZHODLXYNDBSM-UHFFFAOYSA-N 
Literature

Title: Photobehavior of the geometrical isomers of two 1,4-distyrylbenzene analogues with side groups of different electron donor/acceptor character.

Journal: The journal of physical chemistry. A 20101014

Title: Inactivation of epoxide hydrolase by catalysis-induced formation of isoaspartate.

Journal: FEBS letters 20080514

Title: An experimental and theoretical study on the substituent effect of the permanganate oxidation of styrenes.

Journal: Organic & biomolecular chemistry 20030807

Title: Synthesis of p, p'-divinylazobenzene.

Journal: Di 1 jun yi da xue xue bao = Academic journal of the first medical college of PLA 20030301

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