Home Other Building Blocks (2E)-3-[4-(morpholin-4-yl)phenyl]prop-2-enoic acid

(2E)-3-[4-(morpholin-4-yl)phenyl]prop-2-enoic acid

CAS No.:
1430398-57-4
Catalog Number:
AG01EM4P
Molecular Formula:
C13H15NO3
Molecular Weight:
233.2631
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Product Description
Catalog Number:
AG01EM4P
Chemical Name:
(2E)-3-[4-(morpholin-4-yl)phenyl]prop-2-enoic acid
CAS Number:
1430398-57-4
Molecular Formula:
C13H15NO3
Molecular Weight:
233.2631
MDL Number:
MFCD03719705
IUPAC Name:
(E)-3-(4-morpholin-4-ylphenyl)prop-2-enoic acid
InChI:
InChI=1S/C13H15NO3/c15-13(16)6-3-11-1-4-12(5-2-11)14-7-9-17-10-8-14/h1-6H,7-10H2,(H,15,16)/b6-3+
InChI Key:
PTIOADUSEPAKPX-ZZXKWVIFSA-N
SMILES:
OC(=O)/C=C/c1ccc(cc1)N1CCOCC1
Properties
Complexity:
276  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
233.105g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.267g/mol
Monoisotopic Mass:
233.105g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties