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138351-09-4 | Benzaldehyde, 3-[2-(1-piperidinyl)ethoxy]-, hydrochloride (1:1)
CAS No: 138351-09-4 Catalog No: AG0018LQ MDL No:MFCD13186599
Product Description
Catalog Number:
AG0018LQ
Chemical Name:
Benzaldehyde, 3-[2-(1-piperidinyl)ethoxy]-, hydrochloride (1:1)
CAS Number:
138351-09-4
Molecular Formula:
C14H20ClNO2
Molecular Weight:
269.7671
MDL Number:
MFCD13186599
IUPAC Name:
3-(2-piperidin-1-ylethoxy)benzaldehyde;hydrochloride
InChI:
InChI=1S/C14H19NO2.ClH/c16-12-13-5-4-6-14(11-13)17-10-9-15-7-2-1-3-8-15;/h4-6,11-12H,1-3,7-10H2;1H
InChI Key:
NVBJPKOTCLTFBO-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)OCCN1CCCCC1.Cl
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.118g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
269.769g/mol
Monoisotopic Mass:
269.118g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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