Home Other Building Blocks 1-(3,4-dipropoxyphenyl)ethan-1-one

1-(3,4-dipropoxyphenyl)ethan-1-one

CAS No.:
105321-59-3
Catalog Number:
AG019J6O
Molecular Formula:
C14H20O3
Molecular Weight:
236.3068
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Product Description
Catalog Number:
AG019J6O
Chemical Name:
1-(3,4-dipropoxyphenyl)ethan-1-one
CAS Number:
105321-59-3
Molecular Formula:
C14H20O3
Molecular Weight:
236.3068
MDL Number:
MFCD04623529
IUPAC Name:
1-(3,4-dipropoxyphenyl)ethanone
InChI:
InChI=1S/C14H20O3/c1-4-8-16-13-7-6-12(11(3)15)10-14(13)17-9-5-2/h6-7,10H,4-5,8-9H2,1-3H3
InChI Key:
NBTJHXNUCAAKDN-UHFFFAOYSA-N
SMILES:
CCCOc1cc(ccc1OCCC)C(=O)C
Properties
Complexity:
228  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.141g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.311g/mol
Monoisotopic Mass:
236.141g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties