Home Other Building Blocks 4-(3-CYANOPROPOXY)-BENZAMIDE

4-(3-CYANOPROPOXY)-BENZAMIDE

CAS No.:
125439-52-3
Catalog Number:
AG01DYLW
Molecular Formula:
C11H12N2O2
Molecular Weight:
204.2252
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Product Description
Catalog Number:
AG01DYLW
Chemical Name:
4-(3-CYANOPROPOXY)-BENZAMIDE
CAS Number:
125439-52-3
Molecular Formula:
C11H12N2O2
Molecular Weight:
204.2252
MDL Number:
MFCD11173854
IUPAC Name:
4-(3-cyanopropoxy)benzamide
InChI:
InChI=1S/C11H12N2O2/c12-7-1-2-8-15-10-5-3-9(4-6-10)11(13)14/h3-6H,1-2,8H2,(H2,13,14)
InChI Key:
XXSDRFMIQSCLQU-UHFFFAOYSA-N
SMILES:
N#CCCCOc1ccc(cc1)C(=O)N
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.09g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
204.229g/mol
Monoisotopic Mass:
204.09g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
76.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties