2-Propenoyl chloride, 3-(4-nitrophenyl)-, (2E)-


Chemical Name: 2-Propenoyl chloride, 3-(4-nitrophenyl)-, (2E)-
CAS Number: 61921-33-3
Product Number: AG003BN1(AGN-PC-0ODJWA)
Synonyms:
MDL No:
Molecular Formula: C9H6ClNO3
Molecular Weight: 211.6018

Identification/Properties


Properties
Form:
Solid
Computed Properties
Molecular Weight:
211.601g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
211.004g/mol
Monoisotopic Mass:
211.004g/mol
Topological Polar Surface Area:
62.9A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
251
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
3261
Hazard Statements:
H314
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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