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88652-90-8 | 2-Pentenal, 4,4-dimethyl-3-(4-morpholinyl)-, (Z)-
CAS No: 88652-90-8 Catalog No: AG0048LW MDL No:
Product Description
Catalog Number:
AG0048LW
Chemical Name:
2-Pentenal, 4,4-dimethyl-3-(4-morpholinyl)-, (Z)-
CAS Number:
88652-90-8
Molecular Formula:
C11H19NO2
Molecular Weight:
197.2741
IUPAC Name:
4,4-dimethyl-3-morpholin-4-ylpent-2-enal
InChI:
InChI=1S/C11H19NO2/c1-11(2,3)10(4-7-13)12-5-8-14-9-6-12/h4,7H,5-6,8-9H2,1-3H3
InChI Key:
DSQCJNWCMVMQED-UHFFFAOYSA-N
SMILES:
O=C/C=C(/C(C)(C)C)\N1CCOCC1
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.142g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.278g/mol
Monoisotopic Mass:
197.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.4
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