5600-62-4

Name 4-(4-Nitrophenyl)butyric acid
CAS 5600-62-4
EINECS(EC#) 227-019-9
Molecular Formula C10H11NO4
MDL Number MFCD00007387
Molecular Weight 209.2
MOL File 5600-62-4.mol
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Chemical Properties

Melting point  90-93 °C (lit.)
Boiling point  393.8±17.0 °C(Predicted)
density  1.293±0.06 g/cm3(Predicted)
storage temp.  Sealed in dry,Room Temperature
form  powder
pka 4.68±0.10(Predicted)
BRN  2051992
InChI InChI=1S/C10H11NO4/c12-10(13)3-1-2-8-4-6-9(7-5-8)11(14)15/h4-7H,1-3H2,(H,12,13)
InChIKey WQMLUHZFRFCQDB-UHFFFAOYSA-N
SMILES C1(CCCC(O)=O)=CC=C([N+]([O-])=O)C=C1
CAS DataBase Reference 5600-62-4(CAS DataBase Reference)
NIST Chemistry Reference 4-(4-Nitrophenyl)butyric acid(5600-62-4)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302
Precautionary statements  P280-P305+P351+P338
Hazard Codes  Xi,Xn
Risk Statements 
R22:Harmful if swallowed.
Safety Statements 
S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
WGK Germany  3
HazardClass  IRRITANT
HS Code  2921490090

Spectrum Detail

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