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820238-88-8 | Benzaldehyde, 2-[3-(dimethylamino)propoxy]-3-methyl-4-propoxy-
CAS No: 820238-88-8 Catalog No: AG0053BV MDL No:
Product Description
Catalog Number:
AG0053BV
Chemical Name:
Benzaldehyde, 2-[3-(dimethylamino)propoxy]-3-methyl-4-propoxy-
CAS Number:
820238-88-8
Molecular Formula:
C16H25NO3
Molecular Weight:
279.3746
IUPAC Name:
2-[3-(dimethylamino)propoxy]-3-methyl-4-propoxybenzaldehyde
InChI:
InChI=1S/C16H25NO3/c1-5-10-19-15-8-7-14(12-18)16(13(15)2)20-11-6-9-17(3)4/h7-8,12H,5-6,9-11H2,1-4H3
InChI Key:
SQEVIKDQQBDVAN-UHFFFAOYSA-N
SMILES:
CCCOc1ccc(c(c1C)OCCCN(C)C)C=O
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.183g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.38g/mol
Monoisotopic Mass:
279.183g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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