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887694-84-0 | 2,5-dimethyl-1-[2-(morpholin-4-yl)ethyl]-1H-pyrrole-3-carbaldehyde
CAS No: 887694-84-0 Catalog No: AG019UJU MDL No:MFCD07400631
Product Description
Catalog Number:
AG019UJU
Chemical Name:
2,5-dimethyl-1-[2-(morpholin-4-yl)ethyl]-1H-pyrrole-3-carbaldehyde
CAS Number:
887694-84-0
Molecular Formula:
C13H20N2O2
Molecular Weight:
236.3101
MDL Number:
MFCD07400631
IUPAC Name:
2,5-dimethyl-1-(2-morpholin-4-ylethyl)pyrrole-3-carbaldehyde
InChI:
InChI=1S/C13H20N2O2/c1-11-9-13(10-16)12(2)15(11)4-3-14-5-7-17-8-6-14/h9-10H,3-8H2,1-2H3
InChI Key:
QWLYDRSDAWRCRH-UHFFFAOYSA-N
SMILES:
O=Cc1cc(n(c1C)CCN1CCOCC1)C
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.152g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.315g/mol
Monoisotopic Mass:
236.152g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
34.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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