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Home Nitro Compounds 1261894-05-6
1261894-05-6,MFCD18320318
Catalog No.:AA000S1B

1261894-05-6 | 3-(3,4-Methylenedioxyphenyl)-5-nitrobenzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$344.00   $241.00
- +
5g
95%
in stock  
$1,341.00   $939.00
- +
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Technical Information
Catalog Number:
AA000S1B
Chemical Name:
3-(3,4-Methylenedioxyphenyl)-5-nitrobenzoic acid
CAS Number:
1261894-05-6
Molecular Formula:
C14H9NO6
Molecular Weight:
287.2244
MDL Number:
MFCD18320318
SMILES:
OC(=O)c1cc(cc(c1)[N+](=O)[O-])c1ccc2c(c1)OCO2
Properties
Computed Properties
 
Complexity:
422  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
2.7  

Literature
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SDS
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Tags:1261894-05-6 Molecular Formula|1261894-05-6 MDL|1261894-05-6 SMILES|1261894-05-6 3-(3,4-Methylenedioxyphenyl)-5-nitrobenzoic acid