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106001-58-5 | Benzaldehyde, 4-(diethylamino)-3-methoxy-
CAS No: 106001-58-5 Catalog No: AG007W7J MDL No:
Product Description
Catalog Number:
AG007W7J
Chemical Name:
Benzaldehyde, 4-(diethylamino)-3-methoxy-
CAS Number:
106001-58-5
Molecular Formula:
C12H17NO2
Molecular Weight:
207.2689
IUPAC Name:
4-(diethylamino)-3-methoxybenzaldehyde
InChI:
InChI=1S/C12H17NO2/c1-4-13(5-2)11-7-6-10(9-14)8-12(11)15-3/h6-9H,4-5H2,1-3H3
InChI Key:
VNYMBBCHHWJOOP-UHFFFAOYSA-N
SMILES:
CCN(c1ccc(cc1OC)C=O)CC
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.126g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.273g/mol
Monoisotopic Mass:
207.126g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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